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)
-692.03603
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03932 b
(cm-1)
0.00852 c
(cm-1)
0.00700
Dipole Moments
mu_x(Debye)
0.12919 mu_y
(Debye)
-0.56125 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-0.19400
Diff mu Y
(Debye)
0.21800
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.05135
-0.02640
0.00000
2
-0.04130
0.00618
0.00000
3
-0.06683
-0.00144
0.00000
4
-0.06376
-0.00237
0.00000
5
-0.02441
-0.03203
0.00000
6
-0.01620
-0.00711
0.00000
7
-0.03701
0.01960
0.00000
8
-0.04635
-0.02497
0.00000
9
0.01513
-0.07373
0.00000
10
0.04145
0.00620
0.00000
11
-0.00713
-0.00333
0.00000
12
-0.01562
-0.02110
0.00000
13
0.06592
-0.06388
0.00000
14
0.07802
-0.02890
0.00000
15
-0.01502
0.08235
0.00000
16
0.03967
0.09856
0.00000
17
0.06939
0.06253
0.00000
18
0.04903
0.00917
0.00000
19
-0.05584
-0.04080
0.00000
20
-0.03469
0.02923
0.00000
21
0.00294
-0.12040
0.00000
22
0.05513
0.05039
0.00000
23
-0.05362
-0.05037
0.00000
24
0.09145
-0.09090
0.00000
25
0.10741
-0.02265
0.00000
26
-0.00217
-0.03436
0.00000
27
-0.04106
0.11277
0.00000
28
0.05171
0.13310
0.00000
29
0.11136
0.07036
0.00000
30
0.08145
-0.02829
0.00000