Geometry & MOs

Info

ID:	277829
PubChem CID:	103831133
Reduced:	O2N3C16H25 (1)
Stoich.:	A2B3C16D25 (1)
Weight, g/mol:	266.179442
ΔH_f, kcal/mol:	-90.22
Dipole, Da:	5.29
IP(EA), eV:	-9.3(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[1-(4-fluorophenyl)ethyl]-N-methylhexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)N(CCC(=O)N)CC1=CC=CC=C1)N

DOS

IR

Vibrations