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)
-0.27700
Diff mu Y
(Debye)
-0.27700
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.03628
0.00840
0.00000
2
0.00295
-0.01947
0.00000
3
-0.04040
0.05384
0.00000
4
-0.00731
0.01301
0.00000
5
0.04179
0.08858
0.00000
6
-0.00744
0.00091
0.00000
7
0.01820
-0.09016
0.00000
8
-0.01527
0.02126
0.00000
9
-0.02719
-0.01717
0.00000
10
0.01179
-0.00830
0.00000
11
0.07111
-0.09148
0.00000
12
-0.02204
-0.02247
0.00000
13
-0.01764
-0.01126
0.00000
14
-0.00447
0.00285
0.00000
15
-0.00199
-0.01436
0.00000
16
-0.01082
0.02742
0.00000
17
-0.00071
0.01284
0.00000
18
0.00297
0.04155
0.00000
19
-0.04569
-0.32428
0.00000
20
-0.00936
-0.06842
0.00000
21
-0.09632
-0.24919
0.00000
22
0.04774
0.11740
0.00000
23
0.04721
0.22999
0.00000
24
0.02677
-0.05673
0.00000
25
-0.09390
-0.01733
0.00000
26
-0.07395
0.02277
0.00000
27
0.06558
-0.10477
0.00000
28
0.06004
0.23911
0.00000
29
-0.10188
-0.00633
0.00000
30
-0.18099
0.26542
0.00000