Geometry & MOs

Info

ID:	277934
PubChem CID:	103832010
Reduced:	FON3C16H26 (1)
Stoich.:	ABC3D16E26 (1)
Weight, g/mol:	253.215413
ΔH_f, kcal/mol:	-98.64
Dipole, Da:	3.41
IP(EA), eV:	-8.32(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)hexanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations