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)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.40500
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.07368
2
0.00000
0.00000
-0.11711
3
0.00000
0.00000
-0.03608
4
0.00000
0.00000
0.05962
5
0.00000
0.00000
-0.05542
6
0.00000
0.00000
0.07134
7
0.00000
0.00000
0.01284
8
0.00000
0.00000
-0.01747
9
0.00000
0.00000
0.03739
10
0.00000
0.00000
-0.03472
11
0.00000
0.00000
0.00649
12
0.00000
0.00000
-0.02369
13
0.00000
0.00000
0.01416
14
0.00000
0.00000
-0.02605
15
0.00000
0.00000
0.00305
16
0.00000
0.00000
0.00714
17
0.00000
0.00000
-0.01002
18
0.00000
0.00000
-0.00741
19
0.00000
0.00000
-0.32326
20
0.00000
0.00000
0.56732
21
0.00000
0.00000
-0.13608
22
0.00000
0.00000
0.10062
23
0.00000
0.00000
0.00560
24
0.00000
0.00000
-0.11830
25
0.00000
0.00000
0.20334
26
0.00000
0.00000
0.18528
27
0.00000
0.00000
-0.04793
28
0.00000
0.00000
-0.02936
29
0.00000
0.00000
0.05348
30
0.00000
0.00000
0.04226