Geometry & MOs

Info

ID:	39468
PubChem CID:	8140901
Reduced:	NOC11H14 (2)
Stoich.:	ABC11D14 (2)
Weight, g/mol:	352.215078
ΔH_f, kcal/mol:	-76.44
Dipole, Da:	5.38
IP(EA), eV:	-9.07(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S)-N-[2-(2,6-dimethylanilino)-2-oxoethyl]-3-methyl-2-phenylpentanamide

Drug info:

PubChemData

Smile

CC[C@@H](C)[C@@H](C1=CC=CC=C1)C(=O)NCC(=O)NC2=C(C=CC=C2C)C

DOS

IR

Vibrations