Geometry & MOs

Info

ID:	56434
PubChem CID:	17425440
Reduced:	F2N2S2O4C15H16 (1)
Stoich.:	A2B2C2D4E15F16 (1)
Weight, g/mol:	432.159769
ΔH_f, kcal/mol:	-225.84
Dipole, Da:	2.9
IP(EA), eV:	-9.11(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-fluorophenyl)-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-N-methyl-1-phenylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CS(=O)(=O)NCCC1=CC=C(S1)C(=O)NC2=CC=CC=C2OC(F)F

DOS

IR

Vibrations