Geometry & MOs

Info

ID:	13602
PubChem CID:	395817
Reduced:	S3N5O6H7C8 (1)
Stoich.:	A3B5C6D7E8 (1)
Weight, g/mol:	364.955846
ΔH_f, kcal/mol:	-64.58
Dipole, Da:	5.65
IP(EA), eV:	-9.96(-2.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations