Geometry & MOs

Info

ID:	400299
PubChem CID:	135047413
Reduced:	OsS2F6N7O8C17H33 (1)
Stoich.:	AB2C6D7E8F17G33 (1)
Weight, g/mol:	709.01729
ΔH_f, kcal/mol:	-621.16
Dipole, Da:	15.73
IP(EA), eV:	-9.22(-3.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

azane;1-benzothiophene;osmium(2+);trifluoromethanesulfonate

Drug info:

PubChemData

Smile

CC12C=CC(N1)(C(C2C3=CN=CC=C3)C(=O)OC)C.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].N.N.N.N.N.[Os+2]

DOS

IR

Vibrations