Geometry & MOs

Info

ID:	206244
PubChem CID:	80222772
Reduced:	FNOC17H28 (1)
Stoich.:	ABCD17E28 (1)
Weight, g/mol:	211.076392
ΔH_f, kcal/mol:	-114.23
Dipole, Da:	2.19
IP(EA), eV:	-8.47(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloropyridin-2-yl)-4-methylpentan-1-one

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(CCN(CC(C)C)C(C)C)O)F

DOS

IR

Vibrations