Geometry & MOs

Info

ID:	238802
PubChem CID:	93165527
Reduced:	NO4C17H25 (1)
Stoich.:	AB4C17D25 (1)
Weight, g/mol:	307.178358
ΔH_f, kcal/mol:	-182.04
Dipole, Da:	5.69
IP(EA), eV:	-9.36(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S)-3-methyl-2-[[(2R)-3-methyl-2-phenoxybutanoyl]amino]pentanoic acid

Drug info:

PubChemData

Smile

CC[C@@H](C)[C@@H](C(=O)O)NC(=O)[C@@H](C(C)C)OC1=CC=CC=C1

DOS

IR

Vibrations