Geometry & MOs

Info

ID:	13443
PubChem CID:	232643
Reduced:	SN2O4C9H12 (1)
Stoich.:	AB2C4D9E12 (1)
Weight, g/mol:	244.051778
ΔH_f, kcal/mol:	-71.83
Dipole, Da:	4.87
IP(EA), eV:	-10.36(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-nitro-N-propan-2-ylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)NS(=O)(=O)C1=CC=CC(=C1)[N+](=O)[O-]

DOS

IR

Vibrations