Charge: -1
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-1
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)
-0.03500
Diff mu Y
(Debye)
-0.21200
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.03044
0.01864
0.00000
2
-0.02327
-0.02160
0.00000
3
-0.05052
0.02953
0.00000
4
-0.09190
-0.04199
0.00000
5
0.04216
0.03075
0.00000
6
0.02595
-0.03510
0.00000
7
0.04450
0.05175
0.00000
8
-0.07645
-0.09374
0.00000
9
0.04819
0.05666
0.00000
10
0.03728
-0.03884
0.00000
11
0.05714
0.05077
0.00000
12
0.03482
-0.06284
0.00000
13
0.03092
0.05695
0.00000
14
0.01311
-0.00869
0.00000
15
0.03818
0.00047
0.00000
16
-0.03016
-0.02263
0.00000
17
-0.04834
-0.00301
0.00000
18
-0.01401
0.05307
0.00000
19
-0.04740
-0.05119
0.00000
20
-0.00520
0.04885
0.00000
21
0.05116
0.06525
0.00000
22
0.03634
-0.04131
0.00000
23
-0.09827
-0.16368
0.00000
24
0.00464
0.08376
0.00000
25
-0.03940
-0.02134
0.00000
26
0.11770
-0.14906
0.00000
27
0.08079
-0.04856
0.00000
28
-0.04268
-0.06147
0.00000
29
-0.08212
-0.00924
0.00000
30
-0.06094
0.10826
0.00000