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)
-691.62999
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03982 b
(cm-1)
0.00842 c
(cm-1)
0.00695
Dipole Moments
mu_x(Debye)
-0.27351 mu_y
(Debye)
0.67795 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)
-0.18000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.04381
2
0.00000
0.00000
0.08461
3
0.00000
0.00000
0.07461
4
0.00000
0.00000
0.10632
5
0.00000
0.00000
-0.06819
6
0.00000
0.00000
-0.04260
7
0.00000
0.00000
0.05628
8
0.00000
0.00000
-0.02848
9
0.00000
0.00000
-0.02202
10
0.00000
0.00000
-0.07318
11
0.00000
0.00000
0.01591
12
0.00000
0.00000
-0.11736
13
0.00000
0.00000
0.06986
14
0.00000
0.00000
0.00421
15
0.00000
0.00000
-0.00633
16
0.00000
0.00000
-0.05976
17
0.00000
0.00000
0.02070
18
0.00000
0.00000
0.05438
19
0.00000
0.00000
-0.12542
20
0.00000
0.00000
0.14575
21
0.00000
0.00000
-0.01991
22
0.00000
0.00000
-0.11979
23
0.00000
0.00000
-0.07618
24
0.00000
0.00000
0.17033
25
0.00000
0.00000
0.02540
26
0.00000
0.00000
-0.25212
27
0.00000
0.00000
-0.02122
28
0.00000
0.00000
-0.14507
29
0.00000
0.00000
0.03255
30
0.00000
0.00000
0.08627