Geometry & MOs

Info

ID:	135813
PubChem CID:	51939658
Reduced:	OF2N3C17H17 (1)
Stoich.:	AB2C3D17E17 (1)
Weight, g/mol:	373.119319
ΔH_f, kcal/mol:	-69.61
Dipole, Da:	4.73
IP(EA), eV:	-8.78(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-(5-chloro-2-methoxybenzoyl)-N-(5-methylpyridin-2-yl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C[C@H](C1=NC2=CC=CC=C2N1C(F)F)NC3=CC=CC=C3OC

DOS

IR

Vibrations