Geometry & MOs

Info

ID:	443630
PubChem CID:	135259606
Reduced:	ClNSC6H12 (1)
Stoich.:	ABCD6E12 (1)
Weight, g/mol:	352.050237
ΔH_f, kcal/mol:	-29.72
Dipole, Da:	2.42
IP(EA), eV:	-8.92(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[5-(4-chlorophenyl)furan-2-yl]-7-methoxychromen-2-one

Drug info:

PubChemData

Smile

CC(C1CNCCS1)Cl

DOS

IR

Vibrations