Geometry & MOs

Info

ID:	165556
PubChem CID:	74565926
Reduced:	ClFNO4H13C20 (1)
Stoich.:	ABCD4E13F20 (1)
Weight, g/mol:	483.064028
ΔH_f, kcal/mol:	-125.55
Dipole, Da:	7.67
IP(EA), eV:	-9.2(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-(2,3-dichlorophenyl)furan-2-yl]-N-[4-[5-(hydroxymethyl)furan-2-yl]-3-methoxyphenyl]prop-2-enamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=CC=C(O2)C=CC(=O)NC3=C(C=CC(=C3)C(=O)O)Cl)F

DOS

IR

Vibrations