Geometry & MOs

Info

ID:	356456
PubChem CID:	127291529
Reduced:	SO2N5C15H17 (1)
Stoich.:	AB2C5D15E17 (1)
Weight, g/mol:	297.151098
ΔH_f, kcal/mol:	10.07
Dipole, Da:	2.54
IP(EA), eV:	-9.32(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-cyclohexylsulfonylpyrrolidin-2-yl)-1-methylpyrazole

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2CCCN2S(=O)(=O)C3=CNC4=C3C=CC=N4

DOS

IR

Vibrations