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)
-692.28444
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03906 b
(cm-1)
0.00854 c
(cm-1)
0.00701
Dipole Moments
mu_x(Debye)
0.02298 mu_y
(Debye)
-0.00245 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-0.07400
Diff mu Y
(Debye)
-0.19200
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00220
0.01161
0.00000
2
-0.00577
0.01679
0.00000
3
0.01862
-0.00941
0.00000
4
-0.00374
0.00908
0.00000
5
-0.03469
-0.01354
0.00000
6
0.01800
-0.02739
0.00000
7
0.00248
-0.00784
0.00000
8
-0.00359
0.00006
0.00000
9
0.04847
-0.05870
0.00000
10
-0.05989
-0.03031
0.00000
11
-0.00208
0.00087
0.00000
12
-0.00041
-0.00385
0.00000
13
0.13152
0.03840
0.00000
14
-0.09619
0.10538
0.00000
15
-0.00013
0.00018
0.00000
16
-0.00711
0.00337
0.00000
17
-0.00049
-0.00279
0.00000
18
0.00557
0.00438
0.00000
19
0.02287
0.09082
0.00000
20
0.01133
0.08039
0.00000
21
-0.02007
-0.32704
0.00000
22
-0.14223
-0.30284
0.00000
23
-0.00780
-0.01172
0.00000
24
0.23578
-0.05100
0.00000
25
-0.24525
0.07964
0.00000
26
0.00504
-0.00988
0.00000
27
-0.00921
0.01059
0.00000
28
-0.00674
0.00554
0.00000
29
-0.00026
-0.00244
0.00000
30
0.00443
0.00602
0.00000