Geometry & MOs

Info

ID:	13603
PubChem CID:	395818
Reduced:	S3N5O6H7C8 (1)
Stoich.:	A3B5C6D7E8 (1)
Weight, g/mol:	364.955846
ΔH_f, kcal/mol:	-62.31
Dipole, Da:	4.4
IP(EA), eV:	-9.93(-2.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-nitrophenyl)sulfonylamino]-1,3,4-thiadiazole-2-sulfonamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)NC2=NN=C(S2)S(=O)(=O)N

DOS

IR

Vibrations