Geometry & MOs

Info

ID:	83934
PubChem CID:	49862631
Reduced:	FN3H10C12 (1)
Stoich.:	AB3C10D12 (1)
Weight, g/mol:	412.247441
ΔH_f, kcal/mol:	28.85
Dipole, Da:	1.51
IP(EA), eV:	-9.25(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-N-[(1S)-1-[4-[5-(2-cyclopentylethyl)-1,2,4-oxadiazol-3-yl]phenyl]propyl]-3-hydroxypyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)/C=C/C2=NC(=NC=C2)N

DOS

IR

Vibrations