Geometry & MOs

Info

ID:	37879
PubChem CID:	8025301
Reduced:	O3N4C22H24 (1)
Stoich.:	A3B4C22D24 (1)
Weight, g/mol:	392.184841
ΔH_f, kcal/mol:	-80.59
Dipole, Da:	4.44
IP(EA), eV:	-8.95(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-methyl-3-phenylbutanamide

Drug info:

PubChemData

Smile

C[C@@H](CC(=O)N(C)C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C3=CC=CC=C3

DOS

IR

Vibrations