Charge: 0
Inchi:1S/C14H9/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-7,9-10H
Electronic States
Energy
(eV)
-538.14563
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.07406 b
(cm-1)
0.01508 c
(cm-1)
0.01253
Dipole Moments
mu_x(Debye)
0.27998 mu_y
(Debye)
0.13249 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-0.04200
Diff mu Y
(Debye)
-0.01700
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00804
0.00929
0.00000
2
-0.02259
0.05541
0.00000
3
0.02012
0.00244
0.00000
4
-0.00476
-0.03800
0.00000
5
0.06981
0.00849
0.00000
6
-0.08691
-0.07059
0.00000
7
-0.00167
0.06200
0.00000
8
-0.02045
-0.00664
0.00000
9
0.02013
0.04662
0.00000
10
0.01835
0.10716
0.00000
11
0.00029
-0.01884
0.00000
12
0.04278
-0.01653
0.00000
13
-0.04328
-0.07114
0.00000
14
-0.01145
-0.01757
0.00000
15
0.00483
-0.18079
0.00000
16
-0.02648
-0.33772
0.00000
17
0.00049
-0.17964
0.00000
18
-0.02055
0.12719
0.00000
19
0.02823
0.03611
0.00000
20
-0.11310
-0.08286
0.00000
21
-0.16666
0.10077
0.00000
22
0.19800
0.05470
0.00000
23
0.23306
-0.15796
0.00000