Geometry & MOs

Info

ID:	24639
PubChem CID:	611579
Reduced:	NO2H11C13 (1)
Stoich.:	AB2C11D13 (1)
Weight, g/mol:	213.078979
ΔH_f, kcal/mol:	-2.35
Dipole, Da:	1.51
IP(EA), eV:	-9.38(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(furan-2-yl)-1-(6-methylpyridin-3-yl)prop-2-en-1-one

Drug info:

PubChemData

Smile

CC1=NC=C(C=C1)C(=O)C=CC2=CC=CO2

DOS

IR

Vibrations