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)
-691.62999
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03982 b
(cm-1)
0.00842 c
(cm-1)
0.00695
Dipole Moments
mu_x(Debye)
-0.27351 mu_y
(Debye)
0.67795 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-0.03400
Diff mu Y
(Debye)
-0.00100
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.02322
-0.00534
0.00000
2
-0.00015
0.00016
0.00000
3
-0.00066
-0.00079
0.00000
4
-0.00033
-0.00022
0.00000
5
0.00164
0.00283
0.00000
6
0.00022
0.00081
0.00000
7
0.00061
-0.00017
0.00000
8
0.00170
-0.00024
0.00000
9
-0.06741
0.01546
0.00000
10
0.02329
-0.00610
0.00000
11
0.00006
0.00026
0.00000
12
-0.00127
-0.00128
0.00000
13
0.02075
0.01710
0.00000
14
-0.00190
0.00009
0.00000
15
-0.01041
-0.00744
0.00000
16
0.01139
-0.00382
0.00000
17
-0.00088
0.00335
0.00000
18
-0.00334
-0.00294
0.00000
19
-0.26416
0.06170
0.00000
20
0.00118
-0.00111
0.00000
21
0.76161
-0.19065
0.00000
22
-0.26286
0.07208
0.00000
23
-0.01808
0.00528
0.00000
24
-0.22669
-0.21766
0.00000
25
0.00409
-0.00995
0.00000
26
0.01519
0.01342
0.00000
27
0.11496
0.08995
0.00000
28
-0.13110
0.04501
0.00000
29
0.00878
-0.04036
0.00000
30
0.03853
0.03251
0.00000