Geometry & MOs

Info

ID:	70379
PubChem CID:	48413264
Reduced:	BrNSO4C17H18 (1)
Stoich.:	ABCD4E17F18 (1)
Weight, g/mol:	409.99359
ΔH_f, kcal/mol:	-84.36
Dipole, Da:	6.61
IP(EA), eV:	-8.94(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-bromophenyl)cyclopropyl]-1-(4-nitrophenyl)methanesulfonamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)OC)S(=O)(=O)NC2(CC2)C3=CC=C(C=C3)Br

DOS

IR

Vibrations