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)
-692.28642
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)
-0.49500
Diff mu Y
(Debye)
-0.61000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.01389
-0.00165
0.00000
2
0.00511
-0.00620
0.00000
3
-0.03043
0.00967
0.00000
4
0.02400
0.03178
0.00000
5
-0.01734
-0.00407
0.00000
6
0.00018
0.00337
0.00000
7
-0.06235
-0.01567
0.00000
8
-0.01674
0.00429
0.00000
9
0.00445
-0.00254
0.00000
10
-0.00192
-0.01828
0.00000
11
0.02566
0.00908
0.00000
12
-0.00957
-0.01011
0.00000
13
-0.01484
0.01241
0.00000
14
0.02511
0.00830
0.00000
15
0.01243
0.00954
0.00000
16
-0.01047
-0.03436
0.00000
17
0.03138
0.01065
0.00000
18
-0.00202
0.01043
0.00000
19
0.03002
0.06310
0.00000
20
-0.01751
-0.09548
0.00000
21
-0.01736
-0.07951
0.00000
22
-0.04563
-0.17088
0.00000
23
0.01635
0.11161
0.00000
24
-0.15492
0.15986
0.00000
25
0.25144
0.06481
0.00000
26
0.10654
-0.13464
0.00000
27
-0.07933
0.11600
0.00000
28
-0.16221
-0.51727
0.00000
29
0.50046
0.10608
0.00000
30
-0.14841
0.17810
0.00000