Geometry & MOs

Info

ID:	277821
PubChem CID:	103831095
Reduced:	O2N3C16H23 (1)
Stoich.:	A2B3C16D23 (1)
Weight, g/mol:	280.195092
ΔH_f, kcal/mol:	-90.18
Dipole, Da:	2.32
IP(EA), eV:	-8.52(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[1-(4-fluorophenyl)-2-methylpropyl]hexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)NC1=CC(=CC=C1)N2CCCC2=O)N

DOS

IR

Vibrations