Geometry & MOs

Info

ID:	238803
PubChem CID:	93165530
Reduced:	NO4C17H25 (1)
Stoich.:	AB4C17D25 (1)
Weight, g/mol:	307.189592
ΔH_f, kcal/mol:	-180.73
Dipole, Da:	5.63
IP(EA), eV:	-9.45(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[[(2S)-3-methyl-2-[methyl(2-pyridin-4-ylethyl)amino]butanoyl]amino]propanoic acid

Drug info:

PubChemData

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

DOS

IR

Vibrations