Geometry & MOs

Info

ID:	302237
PubChem CID:	124360843
Reduced:	N4O6C19H24 (1)
Stoich.:	A4B6C19D24 (1)
Weight, g/mol:	404.169585
ΔH_f, kcal/mol:	-265.3
Dipole, Da:	10.36
IP(EA), eV:	-9.96(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@@H](C(=O)O)NC(=O)[C@@H](CC(C)C)NC(=O)CN1C(=O)C2=CC=CC=C2NC1=O

DOS

IR

Vibrations