Geometry & MOs

Info

ID:	226643
PubChem CID:	87550953
Reduced:	PN2O3C6H17 (1)
Stoich.:	AB2C3D6E17 (1)
Weight, g/mol:	388.07119
ΔH_f, kcal/mol:	-211.64
Dipole, Da:	2.7
IP(EA), eV:	-9.45(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethoxy-2-(4-methoxyphenyl)-7-(phosphorosomethoxy)chromen-4-one

Drug info:

PubChemData

Smile

C(CCCOP(=O)(N)O)CCN

DOS

IR

Vibrations