Geometry & MOs

Info

ID:	424140
PubChem CID:	135121470
Reduced:	FO5H9C14 (1)
Stoich.:	AB5C9D14 (1)
Weight, g/mol:	292.013851
ΔH_f, kcal/mol:	-168.64
Dipole, Da:	2.86
IP(EA), eV:	-9.89(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)-2-(3-hydroxy-6-methyl-4-oxopyran-2-yl)ethane-1,2-dione

Drug info:

PubChemData

Smile

CC1=CC(=O)C(=C(O1)C(=O)C(=O)C2=CC=C(C=C2)F)O

DOS

IR

Vibrations