Geometry & MOs

Info

ID:	149572
PubChem CID:	53789245
Reduced:	O2H8C11F12 (1)
Stoich.:	A2B8C11D12 (1)
Weight, g/mol:	300.099774
ΔH_f, kcal/mol:	-688.63
Dipole, Da:	2.17
IP(EA), eV:	-11.0(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-hydroxyphenyl)-5,7-dimethoxy-4H-chromen-3-one

Drug info:

PubChemData

Smile

CC(=C)C(=O)OCC(C(C(C(F)(F)F)(C(F)(F)F)F)F)(C(F)(F)F)F

DOS

IR

Vibrations