Geometry & MOs

Info

ID:	171399
PubChem CID:	75371806
Reduced:	IO2S2N4C14H25 (1)
Stoich.:	AB2C2D4E14F25 (1)
Weight, g/mol:	344.108482
ΔH_f, kcal/mol:	-41.96
Dipole, Da:	3.79
IP(EA), eV:	-8.89(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[1-[2-(difluoromethoxy)phenyl]-2-oxopyrrolidin-3-yl]amino]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CCS(=O)(=O)NCCNC(=NC)NCCSC1=CC=CC=C1.I

DOS

IR

Vibrations