Geometry & MOs

Info

ID:	240675
PubChem CID:	93617040
Reduced:	ClSN2O3C12H13 (1)
Stoich.:	ABC2D3E12F13 (1)
Weight, g/mol:	245.083413
ΔH_f, kcal/mol:	-76.42
Dipole, Da:	5.95
IP(EA), eV:	-9.91(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

C1C[C@@H](OC1)CNS(=O)(=O)C2=CC(=C(C=C2)C#N)Cl

DOS

IR

Vibrations