Geometry & MOs

Info

ID:	129043
PubChem CID:	51067948
Reduced:	FN3O4C25H28 (1)
Stoich.:	AB3C4D25E28 (1)
Weight, g/mol:	507.196963
ΔH_f, kcal/mol:	-117.09
Dipole, Da:	8.89
IP(EA), eV:	-8.97(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-N-[2-[5-(2-fluorophenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl]-N-(2-methoxyethyl)benzamide

Drug info:

PubChemData

Smile

COCCN(CC(=O)N1C(CC(=N1)C2=CC=CC=C2F)C3=CC=C(C=C3)OC)C(=O)C4CC4

DOS

IR

Vibrations