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)
-692.28444
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03906 b
(cm-1)
0.00854 c
(cm-1)
0.00701
Dipole Moments
mu_x(Debye)
0.02298 mu_y
(Debye)
-0.00245 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)
-0.20000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.04451
2
0.00000
0.00000
-0.05979
3
0.00000
0.00000
-0.03029
4
0.00000
0.00000
-0.00866
5
0.00000
0.00000
-0.03272
6
0.00000
0.00000
0.05480
7
0.00000
0.00000
-0.01762
8
0.00000
0.00000
0.07686
9
0.00000
0.00000
-0.06510
10
0.00000
0.00000
0.06027
11
0.00000
0.00000
0.06384
12
0.00000
0.00000
-0.07753
13
0.00000
0.00000
0.07830
14
0.00000
0.00000
-0.07276
15
0.00000
0.00000
-0.04486
16
0.00000
0.00000
0.07599
17
0.00000
0.00000
-0.06955
18
0.00000
0.00000
0.05473
19
0.00000
0.00000
0.14323
20
0.00000
0.00000
-0.09550
21
0.00000
0.00000
-0.09394
22
0.00000
0.00000
0.02786
23
0.00000
0.00000
0.11340
24
0.00000
0.00000
0.18204
25
0.00000
0.00000
-0.21575
26
0.00000
0.00000
-0.20386
27
0.00000
0.00000
-0.13724
28
0.00000
0.00000
0.12463
29
0.00000
0.00000
-0.21918
30
0.00000
0.00000
0.01207