Geometry & MOs

Info

ID:	342007
PubChem CID:	127264700
Reduced:	S2O3N4H24C25 (1)
Stoich.:	A2B3C4D24E25 (1)
Weight, g/mol:	357.094726
ΔH_f, kcal/mol:	-26.97
Dipole, Da:	10.49
IP(EA), eV:	-8.73(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-fluorophenyl)-5-methylpyrazol-3-yl]-2-phenylethenesulfonamide

Drug info:

PubChemData

Smile

CCOC(=O)/C(=C/1\NC(=CS1)C)/C(=O)CSC2=NN=C(N2C3=CC=C(C=C3)C)C4=CC=CC=C4

DOS

IR

Vibrations