Charge: -1
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-1
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)
-0.15300
Diff mu Y
(Debye)
0.22500
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00028
-0.00285
0.00000
2
-0.00754
0.01614
0.00000
3
0.01263
-0.03374
0.00000
4
0.01043
0.00240
0.00000
5
-0.00874
-0.00570
0.00000
6
-0.00174
0.00659
0.00000
7
-0.02955
-0.01657
0.00000
8
-0.00026
-0.01045
0.00000
9
0.01301
0.00173
0.00000
10
0.01269
-0.00247
0.00000
11
-0.00512
0.03292
0.00000
12
0.00412
-0.00678
0.00000
13
-0.00557
0.00021
0.00000
14
-0.00331
-0.00385
0.00000
15
0.01561
0.08368
0.00000
16
0.11976
0.01864
0.00000
17
-0.02473
-0.13762
0.00000
18
-0.06951
0.00749
0.00000
19
0.02643
0.10510
0.00000
20
-0.00746
0.01850
0.00000
21
0.01749
0.01476
0.00000
22
0.01402
-0.00074
0.00000
23
-0.00320
-0.02040
0.00000
24
-0.02782
0.02261
0.00000
25
-0.02001
-0.00864
0.00000
26
0.04473
-0.04852
0.00000
27
-0.16134
0.29661
0.00000
28
0.18248
0.17289
0.00000
29
-0.17605
-0.18042
0.00000
30
-0.26906
0.22658
0.00000