Geometry & MOs

Info

ID:	150321
PubChem CID:	53790009
Reduced:	FNC7H11 (2)
Stoich.:	ABC7D11 (2)
Weight, g/mol:	311.220892
ΔH_f, kcal/mol:	-98.26
Dipole, Da:	3.26
IP(EA), eV:	-9.22(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-pentyl-1-[(2S)-2-(propanoylamino)propanoyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CCCCCCNC(CN)C1=CC(=CC(=C1)F)F

DOS

IR

Vibrations