Geometry & MOs

Info

ID:	70376
PubChem CID:	48413261
Reduced:	BrNSO2C17H18 (1)
Stoich.:	ABCD2E17F18 (1)
Weight, g/mol:	354.99901
ΔH_f, kcal/mol:	-17.51
Dipole, Da:	4.68
IP(EA), eV:	-9.59(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-bromophenyl)cyclopropyl]-1-methylpyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

C1CC1(C2=CC=C(C=C2)Br)NS(=O)(=O)CCC3=CC=CC=C3

DOS

IR

Vibrations