Geometry & MOs

Info

ID:	141592
PubChem CID:	52899980
Reduced:	FN3O3H14C21 (1)
Stoich.:	AB3C3D14E21 (1)
Weight, g/mol:	372.125612
ΔH_f, kcal/mol:	-66.34
Dipole, Da:	8.92
IP(EA), eV:	-9.07(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-(5-cyclobutyl-1,3,4-thiadiazol-2-yl)-1-(2-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C1[C@@H](C2=C(C(=CN2C3=CC=CC=C3F)C(=O)O)NC1=O)C4=CC=C(C=C4)C#N

DOS

IR

Vibrations