Geometry & MOs

Info

ID:	371003
PubChem CID:	127341788
Reduced:	NS2O3C8H17 (1)
Stoich.:	AB2C3D8E17 (1)
Weight, g/mol:	261.060569
ΔH_f, kcal/mol:	-136.11
Dipole, Da:	3.88
IP(EA), eV:	-8.56(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-4-(1-methylpyrazol-4-yl)sulfonylthiomorpholine

Drug info:

PubChemData

Smile

CC1CSCCN1S(=O)(=O)CCOC

DOS

IR

Vibrations