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)
-0.17700
Diff mu Y
(Debye)
-0.12800
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.06152
-0.03919
0.00000
2
-0.10671
-0.00535
0.00000
3
0.00907
0.01216
0.00000
4
-0.00907
0.02775
0.00000
5
-0.03045
-0.05400
0.00000
6
-0.02180
-0.08452
0.00000
7
-0.01373
0.00893
0.00000
8
0.01962
0.02792
0.00000
9
-0.11242
0.04046
0.00000
10
0.12256
-0.06617
0.00000
11
0.00490
0.00621
0.00000
12
0.01494
0.03368
0.00000
13
0.02452
0.08358
0.00000
14
0.03180
0.03857
0.00000
15
-0.02241
-0.00981
0.00000
16
-0.00148
-0.00523
0.00000
17
0.01387
-0.01786
0.00000
18
0.01716
0.00118
0.00000
19
0.06053
-0.03422
0.00000
20
-0.10582
-0.00893
0.00000
21
-0.11452
0.02633
0.00000
22
0.12361
-0.05512
0.00000
23
0.01818
0.02450
0.00000
24
0.08547
0.01708
0.00000
25
-0.10109
0.00393
0.00000
26
-0.00149
0.05218
0.00000
27
-0.01797
-0.01561
0.00000
28
0.00731
0.02254
0.00000
29
0.00979
-0.01818
0.00000
30
0.01342
0.00539
0.00000