Geometry & MOs

Info

ID:	356457
PubChem CID:	127291530
Reduced:	SO2N3C14H23 (1)
Stoich.:	AB2C3D14E23 (1)
Weight, g/mol:	359.052897
ΔH_f, kcal/mol:	-65.21
Dipole, Da:	4.18
IP(EA), eV:	-9.29(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(5-chlorothiophen-2-yl)sulfonylpyrrolidin-2-yl]-1,3,5-trimethylpyrazole

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2CCCN2S(=O)(=O)C3CCCCC3

DOS

IR

Vibrations