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)
-691.62999
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03982 b
(cm-1)
0.00842 c
(cm-1)
0.00695
Dipole Moments
mu_x(Debye)
-0.27351 mu_y
(Debye)
0.67795 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)
0.30600
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.02628
2
0.00000
0.00000
0.01314
3
0.00000
0.00000
0.12503
4
0.00000
0.00000
-0.13645
5
0.00000
0.00000
-0.06316
6
0.00000
0.00000
0.06878
7
0.00000
0.00000
0.06731
8
0.00000
0.00000
0.02407
9
0.00000
0.00000
0.03095
10
0.00000
0.00000
-0.02436
11
0.00000
0.00000
-0.07866
12
0.00000
0.00000
-0.01184
13
0.00000
0.00000
-0.01996
14
0.00000
0.00000
0.03666
15
0.00000
0.00000
-0.05318
16
0.00000
0.00000
0.02429
17
0.00000
0.00000
-0.04652
18
0.00000
0.00000
0.03305
19
0.00000
0.00000
-0.07419
20
0.00000
0.00000
0.10509
21
0.00000
0.00000
0.09699
22
0.00000
0.00000
-0.21183
23
0.00000
0.00000
0.20205
24
0.00000
0.00000
-0.12288
25
0.00000
0.00000
-0.02078
26
0.00000
0.00000
0.06873
27
0.00000
0.00000
-0.03436
28
0.00000
0.00000
0.19742
29
0.00000
0.00000
0.02944
30
0.00000
0.00000
0.20622