Charge: 0
Inchi:1S/C18H12/c1-2-7-15-12-18-16(11-14(15)6-1)10-9-13-5-3-4-8-17(13)18/h1-12H
Electronic States
Energy
(eV)
-692.28642
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03906 b
(cm-1)
0.00844 c
(cm-1)
0.00694
Dipole Moments
mu_x(Debye)
-0.13629 mu_y
(Debye)
0.70909 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.04700
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.05800
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.08600
Diff mu X
(Debye)
-0.04300
Diff mu Y
(Debye)
0.02000
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.05200
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.07100
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.07500
Diff mu X
(Debye)
-0.08000
Diff mu Y
(Debye)
-0.15400
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.02800
Diff mu Y
(Debye)
0.01000
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00300
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.30000
Diff mu X
(Debye)
0.01200
Diff mu Y
(Debye)
-0.37300
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
-0.26100
Diff mu X
(Debye)
-0.20100
Diff mu Y
(Debye)
-0.43000
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
-0.14400
Diff mu X
(Debye)
-0.08100
Diff mu Y
(Debye)
0.24700
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.27500
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
-0.09100
Diff mu X
(Debye)
0.06600
Diff mu Y
(Debye)
0.43500
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.17700
Diff mu Y
(Debye)
-0.12800
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.17200
Diff mu Y
(Debye)
0.12600
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.28200
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.62300
Diff mu X
(Debye)
0.04900
Diff mu Y
(Debye)
0.42100
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.66600
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.45500
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.64700
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
-0.00300
Diff mu X
(Debye)
0.21100
Diff mu Y
(Debye)
-0.31200
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
1.21200
Diff mu X
(Debye)
-0.09500
Diff mu Y
(Debye)
-0.70200
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.88400
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.24500
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.36800
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.52700
Diff mu X
(Debye)
-0.28700
Diff mu Y
(Debye)
-0.44500
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.21200
Diff mu X
(Debye)
0.01100
Diff mu Y
(Debye)
0.26000
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
-0.05600
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.26600
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.02400
Diff mu X
(Debye)
0.15900
Diff mu Y
(Debye)
0.19000
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.01000
Diff mu Y
(Debye)
-0.44100
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.08800
Diff mu Y
(Debye)
-0.32000
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.00900
Diff mu Y
(Debye)
0.38200
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.06600
Diff mu Y
(Debye)
-0.27800
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.81300
Diff mu Y
(Debye)
0.04000
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.49500
Diff mu Y
(Debye)
-0.61000
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.35300
Diff mu Y
(Debye)
0.00800
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.33900
Diff mu Y
(Debye)
0.43100
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.34700
Diff mu Y
(Debye)
0.03100
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.46000
Diff mu Y
(Debye)
0.98200
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.24400
Diff mu Y
(Debye)
-1.23000
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.17100
Diff mu Y
(Debye)
0.21400
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.84900
Diff mu Y
(Debye)
-0.57000
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.78000
Diff mu Y
(Debye)
-0.61100
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.27700
Diff mu Y
(Debye)
-0.40800
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.77400
Diff mu Y
(Debye)
4.25300
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.04500
Diff mu Y
(Debye)
-0.35000
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.50600
Diff mu Y
(Debye)
-0.85000
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.32600
Diff mu Y
(Debye)
0.86000
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.31400
Diff mu Y
(Debye)
-1.00000
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.87700
Diff mu Y
(Debye)
-0.03300
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.56800
Diff mu Y
(Debye)
-0.06300
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.31100
Diff mu Y
(Debye)
-0.68300
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.03300
Diff mu Y
(Debye)
-0.05900
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.21500
Diff mu Y
(Debye)
0.58200
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.03500
Diff mu Y
(Debye)
-2.29900
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.36500
Diff mu Y
(Debye)
-1.08800
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.21300
Diff mu Y
(Debye)
0.42000
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.37400
Diff mu Y
(Debye)
0.67100
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.00400
Diff mu Y
(Debye)
0.99000
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.16300
Diff mu Y
(Debye)
-0.11200
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.27200
Diff mu Y
(Debye)
-0.36000
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.32400
Diff mu Y
(Debye)
0.18400
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.18200
Diff mu Y
(Debye)
-0.80300
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.20500
Diff mu Y
(Debye)
-0.55600
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.46700
Diff mu Y
(Debye)
-1.09700
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.77600
Diff mu Y
(Debye)
0.20200
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.26500
Diff mu Y
(Debye)
-0.67300
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.50500
Diff mu Y
(Debye)
1.57000
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.17800
Diff mu Y
(Debye)
-0.88600
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
0.19200
Diff mu Y
(Debye)
-0.52300
Diff mu Z
(Debye)
0.00000
Diff mu X
(Debye)
-0.11500
Diff mu Y
(Debye)
1.00800
Diff mu Z
(Debye)
0.00000