Geometry & MOs

Info

ID:	330209
PubChem CID:	127247196
Reduced:	SO3N5C13H15 (1)
Stoich.:	AB3C5D13E15 (1)
Weight, g/mol:	322.076947
ΔH_f, kcal/mol:	-41.55
Dipole, Da:	2.62
IP(EA), eV:	-9.97(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-3-(4-methylsulfonyl-1H-pyrazol-5-yl)pyrrolidine-1-sulfonamide

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=C(NN=C1)C2CCN(C2)C(=O)C3=NC=CN=C3

DOS

IR

Vibrations