Geometry & MOs

Info

ID:	171845
PubChem CID:	75433212
Reduced:	FN3O4C19H22 (1)
Stoich.:	AB3C4D19E22 (1)
Weight, g/mol:	336.119796
ΔH_f, kcal/mol:	-164.11
Dipole, Da:	3.52
IP(EA), eV:	-9.15(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pyridin-2-yl-[3-[[3-(trifluoromethyl)pyridin-2-yl]amino]pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NC1=C(C=CC=N1)F)NC(=O)C2=CC(=CC(=C2)OC)OC

DOS

IR

Vibrations