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)
-692.28444
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03906 b
(cm-1)
0.00854 c
(cm-1)
0.00701
Dipole Moments
mu_x(Debye)
0.02298 mu_y
(Debye)
-0.00245 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)
0.28000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00749
2
0.00000
0.00000
0.00528
3
0.00000
0.00000
0.00648
4
0.00000
0.00000
-0.00968
5
0.00000
0.00000
-0.00164
6
0.00000
0.00000
0.00031
7
0.00000
0.00000
-0.01665
8
0.00000
0.00000
0.02305
9
0.00000
0.00000
-0.00903
10
0.00000
0.00000
-0.01075
11
0.00000
0.00000
-0.02596
12
0.00000
0.00000
-0.00163
13
0.00000
0.00000
0.01015
14
0.00000
0.00000
0.00847
15
0.00000
0.00000
0.08470
16
0.00000
0.00000
-0.06845
17
0.00000
0.00000
-0.05450
18
0.00000
0.00000
0.08536
19
0.00000
0.00000
-0.07014
20
0.00000
0.00000
-0.01957
21
0.00000
0.00000
0.05666
22
0.00000
0.00000
0.06008
23
0.00000
0.00000
-0.14525
24
0.00000
0.00000
-0.06308
25
0.00000
0.00000
-0.05116
26
0.00000
0.00000
0.04810
27
0.00000
0.00000
-0.45030
28
0.00000
0.00000
0.39190
29
0.00000
0.00000
0.30852
30
0.00000
0.00000
-0.45878