Geometry & MOs

Info

ID:	277837
PubChem CID:	103831164
Reduced:	O2N3C16H23 (1)
Stoich.:	A2B3C16D23 (1)
Weight, g/mol:	277.179027
ΔH_f, kcal/mol:	-66.94
Dipole, Da:	5.31
IP(EA), eV:	-8.28(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[(4-acetamidophenyl)methyl]-2-aminohexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)NC1=CC=C(C=C1)NC(=O)C2CC2)N

DOS

IR

Vibrations