Geometry & MOs

Info

ID:	172225
PubChem CID:	75481559
Reduced:	ClNOF3C8H15 (1)
Stoich.:	ABCD3E8F15 (1)
Weight, g/mol:	287.163377
ΔH_f, kcal/mol:	-268.95
Dipole, Da:	4.87
IP(EA), eV:	-9.5(1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)-N-(cyclobutylmethyl)propanamide

Drug info:

PubChemData

Smile

C1CC(CC(C1)(CN)O)C(F)(F)F.Cl

DOS

IR

Vibrations