Determine point group





Number of atoms 13
Sum formula C6 WO6
Molecular weight 351.92









Rotational Analysis
Rotational Constant A (GHz) 0.6519
Rotational Constant B (GHz) 0.6519
Rotational Constant C (GHz) 0.6519
Classification : Spherical top




Symmetry adapted cartesian coordinates
Atom Number Atomic Symbol Atomic Number x-Coordinate (Angstrom) y-Coordinate (Angstrom) z-Coordinate (Angstrom)
1 W 74 0.000000 0.000000 0.000000
2 C 6 0.000000 0.000000 1.918000
3 C 6 0.000000 1.918000 0.000000
4 C 6 0.000000 0.000000 -1.918000
5 C 6 0.000000 -1.918000 0.000000
6 C 6 1.918000 0.000000 0.000000
7 C 6 -1.918000 0.000000 0.000000
8 O 8 0.000000 0.000000 3.059000
9 O 8 0.000000 3.059000 0.000000
10 O 8 0.000000 0.000000 -3.059000
11 O 8 0.000000 -3.059000 0.000000
12 O 8 3.059000 0.000000 0.000000
13 O 8 -3.059000 0.000000 0.000000









Determined point group Oh
Subgroups
(Number of different orientations)
Cs (2) , Ci , C2 (2) , C3 , C4 , D2 (2) , D3 , D4 , C2v (3) , C3v , C4v , C2h (2) , C4h , D2h (2) , D4h , D2d (2) , D3d , S4 , S6 , T , Th , Td , O



3N representation
group E 8C3 6C2 6C4 3C2 =(C4)2 i 6S4 8S6 3h 6d -
Oh 39 0 -1 5 -5 -3 -1 0 9 5 Submit
Cs 39 - - - - - - - 9 - Submit
Cs 39 - - - - - - - - 5 Submit
Ci 39 - - - - -3 - - - - Submit
C2 39 - -1 - - - - - - - Submit
C2 39 - - - -5 - - - - - Submit
C3 39 0 - - - - - - - - Submit
C4 39 - - 5 -5 - - - - - Submit
D2 39 - - - -5 - - - - - Submit
D2 39 - -1 - -5 - - - - - Submit
D3 39 0 -1 - - - - - - - Submit
D4 39 - -1 5 -5 - - - - - Submit
C2v 39 - - - -5 - - - 9 - Submit
C2v 39 - - - -5 - - - - 5 Submit
C2v 39 - -1 - - - - - 9 5 Submit
C3v 39 0 - - - - - - - 5 Submit
C4v 39 - - 5 -5 - - - 9 5 Submit
C2h 39 - - - -5 -3 - - 9 - Submit
C2h 39 - -1 - - -3 - - - 5 Submit
C4h 39 - - 5 -5 -3 -1 - 9 - Submit
D2h 39 - - - -5 -3 - - 9 - Submit
D2h 39 - -1 - -5 -3 - - 9 5 Submit
D4h 39 - -1 5 -5 -3 -1 - 9 5 Submit
D2d 39 - - - -5 - -1 - - 5 Submit
D2d 39 - -1 - -5 - -1 - 9 - Submit
D3d 39 0 -1 - - -3 - 0 - 5 Submit
S4 39 - - - -5 - -1 - - - Submit
S6 39 0 - - - -3 - 0 - - Submit
T 39 0 - - -5 - - - - - Submit
Th 39 0 - - -5 -3 - 0 9 - Submit
Td 39 0 - - -5 - -1 - - 5 Submit
O 39 0 -1 5 -5 - - - - - Submit









Determine point group from cartesian coordinates Character tables for chemically important point groups Determine point group from internal coordinates

Last update Mai, 23rd 2018 by A. Gelessus, Impressum, Datenschutzerklärung/DataPrivacyStatement