Geometry & MOs

Info

ID:	379473
PubChem CID:	134434477
Reduced:	OF2N4C20H30 (1)
Stoich.:	AB2C4D20E30 (1)
Weight, g/mol:	281.12949
ΔH_f, kcal/mol:	-126.13
Dipole, Da:	4.49
IP(EA), eV:	-8.54(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-(3-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)CC2(CCN(CC2)C)NC(=O)C3=C(C=CC(=C3)F)F

DOS

IR

Vibrations