Geometry & MOs

Info

ID:	245563
PubChem CID:	99453877
Reduced:	ClFSO3N4H20C21 (1)
Stoich.:	ABCD3E4F20G21 (1)
Weight, g/mol:	373.099333
ΔH_f, kcal/mol:	-78.32
Dipole, Da:	4.82
IP(EA), eV:	-9.06(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(3-chlorophenoxy)-N-[2-(2-fluorophenyl)-5-methylpyrazol-3-yl]propanamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl)C4=CC=CC=C4F

DOS

IR

Vibrations