Geometry & MOs

Info

ID:	294625
PubChem CID:	117474677
Reduced:	FN2O4C14H15 (1)
Stoich.:	AB2C4D14E15 (1)
Weight, g/mol:	294.101585
ΔH_f, kcal/mol:	-146.84
Dipole, Da:	4.34
IP(EA), eV:	-8.64(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-fluoro-4-methoxy-3-(methoxymethyl)phenyl]-1-methylpyrazole-3-carboxylic acid

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C(=C1)OC)OC)C2=NNC(=C2)C(=O)O)F

DOS

IR

Vibrations