Geometry & MOs

Info

ID:	333817
PubChem CID:	127252369
Reduced:	SN3O3C11H19 (1)
Stoich.:	AB3C3D11E19 (1)
Weight, g/mol:	273.114713
ΔH_f, kcal/mol:	-87.62
Dipole, Da:	4.42
IP(EA), eV:	-9.71(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethylsulfonyl-2-methyl-2-(4-methyl-1H-pyrazol-5-yl)morpholine

Drug info:

PubChemData

Smile

CCS(=O)(=O)N1CCCC(C1)(C)C2=NC(=NO2)C

DOS

IR

Vibrations