Geometry & MOs

Info

ID:	298479
PubChem CID:	117650134
Reduced:	NO2C9H11 (1)
Stoich.:	AB2C9D11 (1)
Weight, g/mol:	213.055656
ΔH_f, kcal/mol:	-52.63
Dipole, Da:	5.4
IP(EA), eV:	-9.22(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-chloro-5-propan-2-yloxypyridin-2-yl)ethanone

Drug info:

PubChemData

Smile

CC1=C(C=CC(=N1)C(=O)C)OC

DOS

IR

Vibrations