Geometry & MOs

Info

ID:	13627
PubChem CID:	396310
Reduced:	NO4H13C19 (1)
Stoich.:	AB4C13D19 (1)
Weight, g/mol:	319.084458
ΔH_f, kcal/mol:	-12.43
Dipole, Da:	2.45
IP(EA), eV:	-9.36(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(furan-2-yl)-1-[6-[3-(furan-2-yl)prop-2-enoyl]pyridin-2-yl]prop-2-en-1-one

Drug info:

PubChemData

Smile

C1=CC(=NC(=C1)C(=O)C=CC2=CC=CO2)C(=O)C=CC3=CC=CO3

DOS

IR

Vibrations