Geometry & MOs

Info

ID:	277869
PubChem CID:	103831391
Reduced:	N3O3C15H23 (1)
Stoich.:	A3B3C15D23 (1)
Weight, g/mol:	278.199428
ΔH_f, kcal/mol:	-138.28
Dipole, Da:	1.89
IP(EA), eV:	-8.35(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[1-(2-methoxyphenyl)propan-2-yl]hexanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations