Geometry & MOs

Info

ID:	274217
PubChem CID:	103807800
Reduced:	FN2O2C14H21 (1)
Stoich.:	AB2C2D14E21 (1)
Weight, g/mol:	227.163377
ΔH_f, kcal/mol:	-130.62
Dipole, Da:	4.06
IP(EA), eV:	-9.33(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(1-aminohexan-2-yl)-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CCCCC(CN)NC(=O)C1=C(C=C(C=C1)OC)F

DOS

IR

Vibrations