Geometry & MOs

Info

ID:	443657
PubChem CID:	135259675
Reduced:	NO5H21C22 (1)
Stoich.:	AB5C21D22 (1)
Weight, g/mol:	362.079038
ΔH_f, kcal/mol:	-125.94
Dipole, Da:	9.56
IP(EA), eV:	-8.88(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[5-(1,3-benzodioxol-5-yl)furan-2-yl]-7-methoxychromen-2-one

Drug info:

PubChemData

Smile

C/C=C/CC(=O)OC1=C(C=CC(=C1)N(C)C2=CC(=O)OC3=CC=CC=C32)OC

DOS

IR

Vibrations