Geometry & MOs

Info

ID:	339886
PubChem CID:	127261895
Reduced:	N3O4C14H23 (1)
Stoich.:	A3B4C14D23 (1)
Weight, g/mol:	367.225977
ΔH_f, kcal/mol:	-198.71
Dipole, Da:	5.95
IP(EA), eV:	-9.76(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[[(2R)-2-amino-3-phenylpropanoyl]-benzylamino]-4-methylpentanamide

Drug info:

PubChemData

Smile

CC(C)C[C@@H](C(=O)N)N(CC(=O)C)C(=O)[C@@H]1CCC(=O)N1

DOS

IR

Vibrations