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)
-0.14100
Diff mu Y
(Debye)
-0.88800
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.03048
0.00735
0.00000
2
0.00072
-0.00016
0.00000
3
0.00031
0.00093
0.00000
4
0.00041
0.00005
0.00000
5
-0.00025
-0.00095
0.00000
6
0.00029
-0.00021
0.00000
7
0.00023
-0.00014
0.00000
8
-0.00191
0.00089
0.00000
9
-0.00124
0.00023
0.00000
10
-0.00183
0.00026
0.00000
11
-0.00039
0.00132
0.00000
12
-0.00287
-0.00312
0.00000
13
0.00163
0.00149
0.00000
14
-0.00081
0.00382
0.00000
15
-0.01917
-0.01442
0.00000
16
0.03027
-0.00717
0.00000
17
0.01305
-0.06057
0.00000
18
-0.02201
-0.01573
0.00000
19
0.35560
-0.09287
0.00000
20
-0.00790
0.00213
0.00000
21
0.01575
-0.00297
0.00000
22
0.01838
-0.00475
0.00000
23
0.02204
-0.00755
0.00000
24
-0.01716
-0.01661
0.00000
25
0.01041
-0.04247
0.00000
26
0.03400
0.03157
0.00000
27
0.22192
0.18932
0.00000
28
-0.32791
0.10418
0.00000
29
-0.13983
0.67780
0.00000
30
0.22001
0.18794
0.00000