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)
-0.41400
Diff mu Y
(Debye)
-0.36900
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.01051
-0.04017
0.00000
2
-0.02988
-0.06337
0.00000
3
-0.02968
0.03158
0.00000
4
0.05195
-0.02006
0.00000
5
0.02662
-0.01696
0.00000
6
-0.01854
0.06104
0.00000
7
0.00327
0.05227
0.00000
8
0.00366
0.05052
0.00000
9
0.01055
0.02618
0.00000
10
0.02511
0.01479
0.00000
11
-0.02227
-0.05815
0.00000
12
-0.01809
0.00934
0.00000
13
-0.02787
0.01695
0.00000
14
-0.00825
-0.02731
0.00000
15
0.06099
-0.07398
0.00000
16
-0.03001
-0.00460
0.00000
17
-0.04184
0.02190
0.00000
18
0.05177
-0.00873
0.00000
19
0.03597
0.15297
0.00000
20
0.06414
0.29728
0.00000
21
-0.04192
-0.16757
0.00000
22
-0.00642
-0.10968
0.00000
23
-0.07703
-0.21322
0.00000
24
0.10069
-0.11670
0.00000
25
0.01310
-0.02658
0.00000
26
0.10938
-0.13390
0.00000
27
-0.21564
0.26066
0.00000
28
0.03611
0.19497
0.00000
29
0.09038
0.05505
0.00000
30
-0.07292
0.14923
0.00000