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)
-0.02800
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.03270
0.01368
2
0.00000
0.03270
-0.01368
3
0.00000
0.03233
-0.00042
4
0.00000
0.03233
0.00042
5
0.00000
-0.01519
0.03101
6
0.00000
-0.01519
-0.03101
7
0.00000
0.03168
0.02021
8
0.00000
0.03168
-0.02021
9
0.00000
0.09479
0.04973
10
0.00000
0.09479
-0.04973
11
0.00000
0.02010
-0.04666
12
0.00000
0.02010
0.04666
13
0.00000
-0.07532
0.00226
14
0.00000
-0.07532
-0.00226
15
0.00000
-0.10603
0.00487
16
0.00000
-0.10603
-0.00487
17
0.00000
0.00694
0.02040
18
0.00000
0.00694
-0.02040
19
0.00000
-0.02417
0.03618
20
0.00000
-0.02417
-0.03618
21
0.00000
-0.10791
0.08336
22
0.00000
-0.10791
-0.08336
23
0.00000
0.06789
-0.01456
24
0.00000
0.06789
0.01456
25
0.00000
-0.04087
-0.01949
26
0.00000
-0.04087
0.01949
27
0.00000
0.09892
0.04625
28
0.00000
0.09892
-0.04625
29
0.00000
0.00578
-0.02591
30
0.00000
0.00578
0.02591
31
0.00000
0.00190
0.05119
32
0.00000
0.00190
-0.05119