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)
-692.28642
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03906 b
(cm-1)
0.00844 c
(cm-1)
0.00694
Dipole Moments
mu_x(Debye)
-0.13629 mu_y
(Debye)
0.70909 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-0.24400
Diff mu Y
(Debye)
-1.23000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00833
0.01310
0.00000
2
0.02805
-0.00186
0.00000
3
-0.03288
-0.00110
0.00000
4
-0.00803
0.01321
0.00000
5
-0.04388
-0.07548
0.00000
6
-0.02313
-0.01903
0.00000
7
0.03194
0.02761
0.00000
8
-0.02576
0.00674
0.00000
9
0.03106
-0.00166
0.00000
10
-0.01044
-0.00503
0.00000
11
0.11753
-0.09505
0.00000
12
-0.03557
-0.02600
0.00000
13
0.00848
0.01105
0.00000
14
0.00914
0.00959
0.00000
15
-0.03519
-0.01700
0.00000
16
0.00755
-0.01057
0.00000
17
-0.00110
0.04683
0.00000
18
0.00393
0.00246
0.00000
19
0.08416
0.30642
0.00000
20
0.05652
0.10056
0.00000
21
0.10759
0.24778
0.00000
22
-0.00137
0.03651
0.00000
23
0.02917
0.19452
0.00000
24
-0.00764
0.03126
0.00000
25
-0.00475
0.00717
0.00000
26
-0.28972
0.23688
0.00000
27
-0.05427
0.00369
0.00000
28
0.01720
0.02881
0.00000
29
-0.10986
0.02832
0.00000
30
-0.18483
0.23298
0.00000