Charge: 2
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/q+2
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)
-0.32600
Diff mu Y
(Debye)
0.86000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.01019
-0.05812
0.00000
2
-0.05781
-0.11948
0.00000
3
0.01255
0.03307
0.00000
4
0.03515
0.06621
0.00000
5
-0.05201
0.04059
0.00000
6
0.09452
0.04786
0.00000
7
-0.02809
-0.00809
0.00000
8
-0.00888
-0.05711
0.00000
9
0.00629
-0.02686
0.00000
10
-0.03584
-0.01480
0.00000
11
0.05101
-0.03024
0.00000
12
-0.03739
0.05665
0.00000
13
-0.02097
0.01554
0.00000
14
0.04569
0.00534
0.00000
15
0.01673
0.01032
0.00000
16
-0.00804
-0.03392
0.00000
17
0.00810
-0.00369
0.00000
18
-0.03808
0.03844
0.00000
19
0.00941
0.03258
0.00000
20
0.05807
0.29841
0.00000
21
0.03635
0.08356
0.00000
22
0.00164
0.11026
0.00000
23
0.03011
0.06641
0.00000
24
0.00651
-0.01121
0.00000
25
-0.12760
-0.03748
0.00000
26
0.09322
-0.08582
0.00000
27
-0.01016
0.04309
0.00000
28
0.03967
0.10374
0.00000
29
0.05719
0.00740
0.00000
30
0.13033
-0.15509
0.00000