Geometry & MOs

Info

ID:	176188
PubChem CID:	76007047
Reduced:	O3C10H12 (2)
Stoich.:	A3B10C12 (2)
Weight, g/mol:	436.082599
ΔH_f, kcal/mol:	-140.7
Dipole, Da:	12.48
IP(EA), eV:	-8.48(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(5-chlorofuran-2-yl)-3-[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]-1-phenylimidazol-2-one

Drug info:

PubChemData

Smile

CC1(CCC(=O)C2(C1C=O)COC(=O)C34C2CCC(C3O)C(=C)C4=O)C

DOS

IR

Vibrations