Geometry & MOs

Info

ID:	302330
PubChem CID:	124361263
Reduced:	N3O3C22H31 (1)
Stoich.:	A3B3C22D31 (1)
Weight, g/mol:	415.163102
ΔH_f, kcal/mol:	-149.79
Dipole, Da:	4.94
IP(EA), eV:	-8.85(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[[2-[3-hydroxy-4-(2-phenoxyacetyl)phenoxy]acetyl]amino]-4-methylpentanoic acid

Drug info:

PubChemData

Smile

C1CCC(CC1)CNC(=O)CCC(=O)N2C[C@H]3C[C@@H](C2)C4=CC=CC(=O)N4C3

DOS

IR

Vibrations