Geometry & MOs

Info

ID:	132324
PubChem CID:	51343190
Reduced:	SBr2N2O3H14C15 (1)
Stoich.:	AB2C2D3E14F15 (1)
Weight, g/mol:	466.192629
ΔH_f, kcal/mol:	-76.88
Dipole, Da:	7.02
IP(EA), eV:	-8.94(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]-N-[2-(4-methoxyphenyl)ethyl]acetamide

Drug info:

PubChemData

Smile

CS(=O)(=O)N(CC(=O)NC1=CC(=CC=C1)Br)C2=CC=CC=C2Br

DOS

IR

Vibrations