Geometry & MOs

Info

ID:	266651
PubChem CID:	103577819
Reduced:	ClF2N2O2C11H13 (1)
Stoich.:	AB2C2D2E11F13 (1)
Weight, g/mol:	258.032668
ΔH_f, kcal/mol:	-177.96
Dipole, Da:	2.07
IP(EA), eV:	-9.29(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dichloro-N-(3-methylbut-2-enyl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(N=C1)Cl)NC(=O)CCOCC(F)F

DOS

IR

Vibrations