Geometry & MOs

Info

ID:	31112
PubChem CID:	854575
Reduced:	FO4H13C15 (1)
Stoich.:	AB4C13D15 (1)
Weight, g/mol:	318.100442
ΔH_f, kcal/mol:	-168.8
Dipole, Da:	4.76
IP(EA), eV:	-9.07(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methoxy-3-(1-phenylpyrazol-4-yl)chromen-4-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1O)O)C(=O)COC2=CC=C(C=C2)F

DOS

IR

Vibrations