Charge: 2
Inchi:1S/C18H12/c1-3-7-15-13(5-1)9-11-18-16-8-4-2-6-14(16)10-12-17(15)18/h1-12H/q+2
Electronic States
Energy
(eV)
-691.62195
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2h
Symmetry Elements
E
C2(z)
sigmah(xy)
i
Rotational Constants
(cm-1)
0.04269 b
(cm-1)
0.00858 c
(cm-1)
0.00715
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.16900
Diff mu Y
(Debye)
-1.07500
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.04085
-0.03277
0.00000
2
0.04084
-0.03278
0.00000
3
-0.04100
0.04645
0.00000
4
-0.02786
-0.04242
0.00000
5
0.08476
0.01597
0.00000
6
-0.05345
0.04700
0.00000
7
-0.00015
-0.07475
0.00000
8
-0.01991
0.06011
0.00000
9
0.00270
-0.01685
0.00000
10
-0.01564
-0.01310
0.00000
11
-0.01565
-0.01309
0.00000
12
0.00271
-0.01684
0.00000
13
-0.01990
0.06010
0.00000
14
-0.00016
-0.07475
0.00000
15
-0.05345
0.04701
0.00000
16
0.08475
0.01596
0.00000
17
-0.02786
-0.04241
0.00000
18
-0.04099
0.04644
0.00000
19
-0.02514
-0.03206
0.00000
20
0.02961
0.10683
0.00000
21
0.09497
-0.00458
0.00000
22
0.09426
-0.07817
0.00000
23
0.10338
0.23152
0.00000
24
0.05677
-0.10024
0.00000
25
0.05679
-0.10026
0.00000
26
0.10337
0.23154
0.00000
27
0.09421
-0.07811
0.00000
28
0.09493
-0.00458
0.00000
29
0.02961
0.10683
0.00000
30
-0.02515
-0.03208
0.00000