Geometry & MOs

Info

ID:	70365
PubChem CID:	48413247
Reduced:	BrSO2N3C13H16 (1)
Stoich.:	ABC2D3E13F16 (1)
Weight, g/mol:	317.00851
ΔH_f, kcal/mol:	-6.08
Dipole, Da:	4.39
IP(EA), eV:	-9.68(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(CCC#N)S(=O)(=O)NC1(CC1)C2=CC=C(C=C2)Br

DOS

IR

Vibrations