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)
0.11000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.07293
2
0.00000
0.00000
-0.06376
3
0.00000
0.00000
-0.00540
4
0.00000
0.00000
0.00458
5
0.00000
0.00000
-0.08017
6
0.00000
0.00000
-0.08821
7
0.00000
0.00000
0.03967
8
0.00000
0.00000
0.08424
9
0.00000
0.00000
-0.01141
10
0.00000
0.00000
-0.04358
11
0.00000
0.00000
0.01526
12
0.00000
0.00000
0.07862
13
0.00000
0.00000
0.08150
14
0.00000
0.00000
0.06024
15
0.00000
0.00000
0.08967
16
0.00000
0.00000
0.03149
17
0.00000
0.00000
-0.07709
18
0.00000
0.00000
-0.06495
19
0.00000
0.00000
-0.09841
20
0.00000
0.00000
-0.06634
21
0.00000
0.00000
-0.00370
22
0.00000
0.00000
-0.06190
23
0.00000
0.00000
0.12682
24
0.00000
0.00000
0.16620
25
0.00000
0.00000
0.12498
26
0.00000
0.00000
0.11240
27
0.00000
0.00000
0.16519
28
0.00000
0.00000
0.06192
29
0.00000
0.00000
-0.14905
30
0.00000
0.00000
-0.11361