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)
-0.50500
Diff mu Y
(Debye)
1.57000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.01866
0.00471
0.00000
2
-0.01763
0.00450
0.00000
3
0.00007
0.00007
0.00000
4
0.00023
0.00058
0.00000
5
-0.00039
-0.00048
0.00000
6
-0.00033
-0.00054
0.00000
7
-0.00073
0.00083
0.00000
8
-0.03129
0.01106
0.00000
9
-0.00440
0.00100
0.00000
10
-0.02829
0.00694
0.00000
11
0.00086
-0.00144
0.00000
12
-0.01876
-0.01841
0.00000
13
0.01080
0.00962
0.00000
14
-0.00684
0.02875
0.00000
15
0.02348
0.01949
0.00000
16
-0.02167
0.00574
0.00000
17
-0.00656
0.02997
0.00000
18
0.00343
0.00216
0.00000
19
0.22397
-0.05757
0.00000
20
0.20972
-0.05770
0.00000
21
0.06332
-0.01666
0.00000
22
0.31833
-0.09186
0.00000
23
0.36465
-0.11605
0.00000
24
-0.11317
-0.10582
0.00000
25
0.07957
-0.32191
0.00000
26
0.22123
0.20460
0.00000
27
-0.27143
-0.23608
0.00000
28
0.25428
-0.07925
0.00000
29
0.06631
-0.34459
0.00000
30
-0.02755
-0.02192
0.00000