Charge: -1
Inchi:1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H/q-1
Electronic States
Energy
(eV)
-768.41876
Description
S1
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.02837 b
(cm-1)
0.00856 c
(cm-1)
0.00657
Dipole Moments
mu_x(Debye)
-0.01429 mu_y
(Debye)
-0.01154 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)
0.29500
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.03761
2
0.00000
0.00000
0.00420
3
0.00000
0.00000
-0.10792
4
0.00000
0.00000
-0.07972
5
0.00000
0.00000
0.08924
6
0.00000
0.00000
0.11224
7
0.00000
0.00000
0.01300
8
0.00000
0.00000
-0.01872
9
0.00000
0.00000
0.03727
10
0.00000
0.00000
-0.04066
11
0.00000
0.00000
0.06456
12
0.00000
0.00000
0.05078
13
0.00000
0.00000
-0.06528
14
0.00000
0.00000
-0.00480
15
0.00000
0.00000
0.05675
16
0.00000
0.00000
-0.02716
17
0.00000
0.00000
-0.00020
18
0.00000
0.00000
0.00581
19
0.00000
0.00000
0.01243
20
0.00000
0.00000
-0.01151
21
0.00000
0.00000
0.25043
22
0.00000
0.00000
0.15274
23
0.00000
0.00000
-0.09249
24
0.00000
0.00000
-0.25296
25
0.00000
0.00000
0.13394
26
0.00000
0.00000
-0.22197
27
0.00000
0.00000
-0.10383
28
0.00000
0.00000
-0.07898
29
0.00000
0.00000
-0.05380
30
0.00000
0.00000
-0.08744
31
0.00000
0.00000
-0.15408
32
0.00000
0.00000
-0.11920