Geometry & MOs

Info

ID:	131575
PubChem CID:	51230498
Reduced:	SN2O3C19H22 (1)
Stoich.:	AB2C3D19E22 (1)
Weight, g/mol:	377.231456
ΔH_f, kcal/mol:	-79.9
Dipole, Da:	3.82
IP(EA), eV:	-8.56(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[4-[2-(2-methylpropylcarbamoyl)anilino]-4-oxobutyl]carbamate

Drug info:

PubChemData

Smile

CC(C)CNC(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)S(=O)C

DOS

IR

Vibrations