Geometry & MOs

Info

ID:	277891
PubChem CID:	103831637
Reduced:	ON2C16H32 (1)
Stoich.:	AB2C16D32 (1)
Weight, g/mol:	270.15437
ΔH_f, kcal/mol:	-110.63
Dipole, Da:	2.44
IP(EA), eV:	-9.51(1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[2-(3,5-difluorophenyl)ethyl]hexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)NC1CC(CCC1C(C)C)C)N

DOS

IR

Vibrations