Geometry & MOs

Info

ID:	156361
PubChem CID:	56370281
Reduced:	BrNSO3C18H26 (1)
Stoich.:	ABCD3E18F26 (1)
Weight, g/mol:	422.98098
ΔH_f, kcal/mol:	-135.86
Dipole, Da:	2.1
IP(EA), eV:	-9.93(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromophenyl)sulfonyl-N-(1,1-dioxothiolan-3-yl)-2-methylpropanamide

Drug info:

PubChemData

Smile

CC(C)(C(=O)NC1CCCCCCC1)S(=O)(=O)C2=CC=C(C=C2)Br

DOS

IR

Vibrations