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)
0.05100
Diff mu Y
(Debye)
-0.05800
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.13181
-0.00214
0.00000
2
0.10777
-0.07147
0.00000
3
-0.05001
-0.04435
0.00000
4
0.03740
-0.05343
0.00000
5
-0.03385
0.01483
0.00000
6
0.01794
-0.00882
0.00000
7
-0.03143
0.01574
0.00000
8
0.02061
0.03646
0.00000
9
-0.02127
0.01209
0.00000
10
0.01790
-0.01469
0.00000
11
0.03383
0.03825
0.00000
12
0.05741
0.05812
0.00000
13
0.01727
0.02638
0.00000
14
0.00589
0.00325
0.00000
15
-0.08790
-0.01358
0.00000
16
-0.03396
-0.00045
0.00000
17
0.02288
-0.04795
0.00000
18
0.05490
0.04662
0.00000
19
-0.13932
-0.02511
0.00000
20
0.09862
-0.11503
0.00000
21
-0.02943
-0.01609
0.00000
22
0.01733
-0.01862
0.00000
23
0.02828
0.05032
0.00000
24
0.02669
0.01696
0.00000
25
-0.02912
-0.00518
0.00000
26
0.06550
0.05295
0.00000
27
-0.08966
-0.01367
0.00000
28
-0.00298
0.09671
0.00000
29
-0.00603
-0.05276
0.00000
30
0.01759
0.09073
0.00000