Geometry & MOs

Info

ID:	70082
PubChem CID:	47207489
Reduced:	NSO4C13H19 (1)
Stoich.:	ABC4D13E19 (1)
Weight, g/mol:	318.98778
ΔH_f, kcal/mol:	-161.75
Dipole, Da:	4.71
IP(EA), eV:	-9.17(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-3-methylphenyl)-2-ethylsulfonylacetamide

Drug info:

PubChemData

Smile

CCCS(=O)(=O)CC(=O)NCC1=CC=C(C=C1)OC

DOS

IR

Vibrations