Geometry & MOs

Info

ID:	368174
PubChem CID:	127327725
Reduced:	SO2N3C14H23 (1)
Stoich.:	AB2C3D14E23 (1)
Weight, g/mol:	295.110296
ΔH_f, kcal/mol:	-64.88
Dipole, Da:	6.57
IP(EA), eV:	-9.29(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-4-[1-(1-methylimidazol-4-yl)sulfonylpyrrolidin-3-yl]pyrazole

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2CCN(C2)S(=O)(=O)C3CCCCC3

DOS

IR

Vibrations