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)
0.12600
Diff mu Y
(Debye)
-0.26500
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.08450
0.01486
0.00000
2
-0.00605
-0.01753
0.00000
3
-0.02827
-0.05067
0.00000
4
-0.00075
-0.00363
0.00000
5
-0.01399
0.04027
0.00000
6
-0.02093
-0.01700
0.00000
7
0.04429
-0.06097
0.00000
8
0.00392
0.05745
0.00000
9
0.03873
0.04322
0.00000
10
-0.00357
-0.04128
0.00000
11
-0.00002
-0.06388
0.00000
12
0.02914
0.06599
0.00000
13
0.04435
0.04835
0.00000
14
0.00968
-0.05606
0.00000
15
0.09760
0.04979
0.00000
16
0.00143
0.03857
0.00000
17
-0.02904
0.04182
0.00000
18
-0.07911
-0.09753
0.00000
19
-0.08332
0.01779
0.00000
20
-0.01001
-0.03499
0.00000
21
0.02982
0.00879
0.00000
22
0.00623
-0.00767
0.00000
23
0.00239
0.04964
0.00000
24
-0.00242
0.09560
0.00000
25
-0.04291
-0.06861
0.00000
26
-0.00870
0.10465
0.00000
27
0.08660
0.06304
0.00000
28
-0.02980
-0.05822
0.00000
29
0.06691
0.06033
0.00000
30
-0.04935
-0.13239
0.00000