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)
-0.09500
Diff mu Y
(Debye)
-0.70200
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.06746
-0.08169
0.00000
2
-0.06904
-0.06235
0.00000
3
0.00404
-0.04637
0.00000
4
-0.00357
-0.03538
0.00000
5
0.05294
-0.03037
0.00000
6
-0.07722
0.00004
0.00000
7
-0.00227
-0.00382
0.00000
8
-0.05635
0.03759
0.00000
9
0.08793
0.01898
0.00000
10
-0.08221
0.06326
0.00000
11
0.03570
0.01770
0.00000
12
0.03850
0.06929
0.00000
13
0.02246
0.02975
0.00000
14
0.00766
0.01702
0.00000
15
-0.02773
0.01250
0.00000
16
-0.04227
0.02513
0.00000
17
0.01589
-0.03865
0.00000
18
0.02286
-0.00600
0.00000
19
0.05231
-0.13502
0.00000
20
-0.10133
-0.17705
0.00000
21
0.10535
0.07279
0.00000
22
-0.05981
0.14605
0.00000
23
-0.05728
0.03420
0.00000
24
-0.02089
0.07991
0.00000
25
0.07141
0.03690
0.00000
26
0.06611
0.03487
0.00000
27
-0.01491
-0.00753
0.00000
28
-0.02408
0.07924
0.00000
29
0.04957
-0.03011
0.00000
30
-0.00420
0.02500
0.00000