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)
-692.28642
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03906 b
(cm-1)
0.00844 c
(cm-1)
0.00694
Dipole Moments
mu_x(Debye)
-0.13629 mu_y
(Debye)
0.70909 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)
0.66600
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.03036
2
0.00000
0.00000
-0.01273
3
0.00000
0.00000
0.03272
4
0.00000
0.00000
-0.08967
5
0.00000
0.00000
0.02759
6
0.00000
0.00000
-0.01488
7
0.00000
0.00000
0.01781
8
0.00000
0.00000
0.04954
9
0.00000
0.00000
-0.01897
10
0.00000
0.00000
0.00553
11
0.00000
0.00000
0.06324
12
0.00000
0.00000
-0.00241
13
0.00000
0.00000
-0.00107
14
0.00000
0.00000
-0.01537
15
0.00000
0.00000
-0.05464
16
0.00000
0.00000
-0.04730
17
0.00000
0.00000
-0.02626
18
0.00000
0.00000
-0.03698
19
0.00000
0.00000
-0.28582
20
0.00000
0.00000
0.30382
21
0.00000
0.00000
0.06679
22
0.00000
0.00000
0.01901
23
0.00000
0.00000
-0.06662
24
0.00000
0.00000
0.09968
25
0.00000
0.00000
0.04550
26
0.00000
0.00000
-0.28350
27
0.00000
0.00000
0.27335
28
0.00000
0.00000
0.43335
29
0.00000
0.00000
0.34700
30
0.00000
0.00000
0.16046