Geometry & MOs

Info

ID:	61997
PubChem CID:	26716803
Reduced:	NSO5C19H21 (1)
Stoich.:	ABC5D19E21 (1)
Weight, g/mol:	404.140593
ΔH_f, kcal/mol:	-183.1
Dipole, Da:	10.13
IP(EA), eV:	-8.96(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 4-[[2-[methyl-(4-methylphenyl)sulfonylamino]acetyl]amino]benzoate

Drug info:

PubChemData

Smile

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CCS(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations