Charge: 0
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
Electronic States
Energy
(eV)
-768.42261
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.01712 b
(cm-1)
0.01286 c
(cm-1)
0.00734
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.03249
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)
0.10300
Eigenvectors
#
X
Y
Z
1
0.00000
-0.02153
-0.04325
2
0.00000
0.02153
-0.04325
3
0.00000
-0.02215
-0.01940
4
0.00000
0.02215
-0.01940
5
0.00000
-0.07791
-0.03413
6
0.00000
0.07791
-0.03413
7
0.00000
-0.00632
0.01310
8
0.00000
0.00632
0.01310
9
0.00000
-0.00948
-0.00865
10
0.00000
0.00948
-0.00866
11
0.00000
-0.03641
-0.01408
12
0.00000
0.03641
-0.01408
13
0.00000
-0.10773
-0.01666
14
0.00000
0.10773
-0.01667
15
0.00000
-0.08927
0.00365
16
0.00000
0.08927
0.00365
17
0.00000
0.01617
0.04445
18
0.00000
-0.01617
0.04445
19
0.00000
0.00054
0.06581
20
0.00000
-0.00054
0.06581
21
0.00000
-0.09046
0.04282
22
0.00000
0.09046
0.04282
23
0.00000
-0.01047
0.00455
24
0.00000
0.01047
0.00455
25
0.00000
-0.12567
-0.00816
26
0.00000
0.12567
-0.00816
27
0.00000
0.03317
-0.03592
28
0.00000
-0.03317
-0.03592
29
0.00000
0.01442
0.04856
30
0.00000
-0.01442
0.04856
31
0.00000
-0.01523
0.05726
32
0.00000
0.01523
0.05726