Charge: -1
Inchi:1S/C20H12/c1-2-8-16-15(7-1)17-9-3-5-13-11-12-14-6-4-10-18(16)20(14)19(13)17/h1-12H/q-1
Electronic States
Energy
(eV)
-767.76437
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.01688 b
(cm-1)
0.01298 c
(cm-1)
0.00734
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.73345
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)
0.00000
Eigenvectors
#
X
Y
Z
1
0.05624
0.00000
0.00000
2
-0.05624
0.00000
0.00000
3
-0.03736
0.00000
0.00000
4
0.03736
0.00000
0.00000
5
0.01386
0.00000
0.00000
6
-0.01386
0.00000
0.00000
7
0.12786
0.00000
0.00000
8
-0.12786
0.00000
0.00000
9
0.00692
0.00000
0.00000
10
-0.00692
0.00000
0.00000
11
-0.04687
0.00000
0.00000
12
0.04687
0.00000
0.00000
13
-0.03294
0.00000
0.00000
14
0.03294
0.00000
0.00000
15
-0.00587
0.00000
0.00000
16
0.00587
0.00000
0.00000
17
-0.01716
0.00000
0.00000
18
0.01716
0.00000
0.00000
19
0.04126
0.00000
0.00000
20
-0.04126
0.00000
0.00000
21
0.25180
0.00000
0.00000
22
-0.25180
0.00000
0.00000
23
0.19932
0.00000
0.00000
24
-0.19932
0.00000
0.00000
25
0.12438
0.00000
0.00000
26
-0.12438
0.00000
0.00000
27
-0.02177
0.00000
0.00000
28
0.02177
0.00000
0.00000
29
-0.24832
0.00000
0.00000
30
0.24832
0.00000
0.00000
31
0.01804
0.00000
0.00000
32
-0.01804
0.00000
0.00000