Charge: 2
Inchi:1S/C18H12/c1-2-7-15-12-18-16(11-14(15)6-1)10-9-13-5-3-4-8-17(13)18/h1-12H/q+2
Electronic States
Energy
(eV)
-692.03603
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03932 b
(cm-1)
0.00852 c
(cm-1)
0.00700
Dipole Moments
mu_x(Debye)
0.12919 mu_y
(Debye)
-0.56125 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)
0.15200
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.12698
2
0.00000
0.00000
-0.05389
3
0.00000
0.00000
0.07182
4
0.00000
0.00000
0.03906
5
0.00000
0.00000
-0.01634
6
0.00000
0.00000
-0.07608
7
0.00000
0.00000
-0.02213
8
0.00000
0.00000
0.05851
9
0.00000
0.00000
-0.07832
10
0.00000
0.00000
-0.01828
11
0.00000
0.00000
-0.06373
12
0.00000
0.00000
-0.01262
13
0.00000
0.00000
-0.01724
14
0.00000
0.00000
0.08422
15
0.00000
0.00000
-0.07604
16
0.00000
0.00000
0.02014
17
0.00000
0.00000
0.06655
18
0.00000
0.00000
-0.05351
19
0.00000
0.00000
0.24401
20
0.00000
0.00000
-0.09780
21
0.00000
0.00000
-0.12344
22
0.00000
0.00000
-0.01172
23
0.00000
0.00000
0.10065
24
0.00000
0.00000
-0.02128
25
0.00000
0.00000
0.20107
26
0.00000
0.00000
-0.01802
27
0.00000
0.00000
-0.14649
28
0.00000
0.00000
0.04945
29
0.00000
0.00000
0.15739
30
0.00000
0.00000
-0.08484