Geometry & MOs

Info

ID:	146416
PubChem CID:	53687018
Reduced:	ON3H17C19 (1)
Stoich.:	AB3C17D19 (1)
Weight, g/mol:	377.231456
ΔH_f, kcal/mol:	40.81
Dipole, Da:	1.79
IP(EA), eV:	-8.5(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[(2S)-1-amino-3,3-dimethyl-1-oxobutan-2-yl]-N'-hydroxy-2-[3-(4-methylphenyl)propyl]butanediamide

Drug info:

PubChemData

Smile

CC1=CC(=C(N=C1)N)NC2=CC=CC=C2C(=O)C3=CC=CC=C3

DOS

IR

Vibrations