Geometry & MOs

Info

ID:	302278
PubChem CID:	124361019
Reduced:	N3O6C17H21 (1)
Stoich.:	A3B6C17D21 (1)
Weight, g/mol:	490.217597
ΔH_f, kcal/mol:	-252.9
Dipole, Da:	4.93
IP(EA), eV:	-9.64(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-5-(carbamoylamino)-2-[[(2R)-2-[[2-(2,4-dioxo-1H-quinazolin-3-yl)acetyl]amino]-4-methylpentanoyl]amino]pentanoic acid

Drug info:

PubChemData

Smile

CC(C)C[C@H](C(=O)N[C@@H](CO)C(=O)O)N1C(=O)C2=CC=CC=C2NC1=O

DOS

IR

Vibrations