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)
-0.50600
Diff mu Y
(Debye)
-0.85000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.04744
0.00991
0.00000
2
-0.00926
0.04936
0.00000
3
-0.11747
-0.03325
0.00000
4
0.09484
-0.03631
0.00000
5
-0.01827
-0.00162
0.00000
6
-0.01104
-0.01977
0.00000
7
0.07119
0.03310
0.00000
8
-0.01794
-0.03107
0.00000
9
0.01618
0.06063
0.00000
10
0.02075
0.00780
0.00000
11
-0.02944
-0.05822
0.00000
12
0.00174
0.03929
0.00000
13
0.01513
-0.03404
0.00000
14
-0.04738
-0.00631
0.00000
15
-0.03200
0.05305
0.00000
16
-0.01358
-0.08450
0.00000
17
0.06008
-0.00057
0.00000
18
-0.06178
0.06159
0.00000
19
0.06171
0.06253
0.00000
20
-0.00429
0.06318
0.00000
21
-0.05027
-0.16182
0.00000
22
0.02261
0.01319
0.00000
23
-0.01689
-0.03492
0.00000
24
0.02326
-0.04235
0.00000
25
0.08883
0.02695
0.00000
26
0.10346
-0.07385
0.00000
27
-0.02458
0.04477
0.00000
28
0.05039
0.10307
0.00000
29
0.03768
-0.00635
0.00000
30
0.07519
-0.10229
0.00000