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
-0.00028
0.00000
0.00000
2
0.00028
0.00000
0.00000
3
0.00272
0.00000
0.00000
4
-0.00272
0.00000
0.00000
5
0.01446
0.00000
0.00000
6
-0.01446
0.00000
0.00000
7
-0.00217
0.00000
0.00000
8
0.00217
0.00000
0.00000
9
-0.02984
0.00000
0.00000
10
0.02984
0.00000
0.00000
11
-0.01635
0.00000
0.00000
12
0.01635
0.00000
0.00000
13
-0.03969
0.00000
0.00000
14
0.03969
0.00000
0.00000
15
0.04398
0.00000
0.00000
16
-0.04398
0.00000
0.00000
17
0.04567
0.00000
0.00000
18
-0.04567
0.00000
0.00000
19
-0.08794
0.00000
0.00000
20
0.08794
0.00000
0.00000
21
-0.21632
0.00000
0.00001
22
0.21632
0.00000
0.00001
23
0.05804
0.00001
0.00000
24
-0.05804
-0.00001
0.00000
25
0.18511
0.00000
0.00000
26
-0.18511
0.00000
0.00000
27
0.13916
-0.00001
0.00000
28
-0.13916
0.00001
0.00000
29
-0.20555
0.00000
0.00001
30
0.20555
0.00000
0.00001
31
0.41828
0.00001
0.00000
32
-0.41828
-0.00001
0.00000