Geometry & MOs

Info

ID:	29999
PubChem CID:	838806
Reduced:	NO3H19C22 (1)
Stoich.:	AB3C19D22 (1)
Weight, g/mol:	302.094294
ΔH_f, kcal/mol:	-15.66
Dipole, Da:	5.36
IP(EA), eV:	-8.36(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-3-(furan-2-ylmethylidene)-2-phenylchromen-4-one

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)[C@@H]2C(=CC3=CC=CO3)C(=O)C4=CC=CC=C4O2

DOS

IR

Vibrations