Geometry & MOs

Info

ID:	281608
PubChem CID:	103914114
Reduced:	ClO2N3C13H18 (1)
Stoich.:	AB2C3D13E18 (1)
Weight, g/mol:	317.069782
ΔH_f, kcal/mol:	-85.22
Dipole, Da:	4.74
IP(EA), eV:	-8.91(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(2,6-dichloroanilino)-2-oxoethyl]amino]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N)NCC(=O)NC1=CC=CC=C1Cl

DOS

IR

Vibrations