Geometry & MOs

Info

ID:	350120
PubChem CID:	127277198
Reduced:	SN2O2C10H22 (1)
Stoich.:	AB2C2D10E22 (1)
Weight, g/mol:	271.135448
ΔH_f, kcal/mol:	-108.84
Dipole, Da:	5.33
IP(EA), eV:	-9.41(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-ethylpyrrolidin-1-yl)sulfonyl-1,3,5-trimethylpyrazole

Drug info:

PubChemData

Smile

CCC1CCCN1S(=O)(=O)N(CC)CC

DOS

IR

Vibrations