Geometry & MOs

Info

ID:	368180
PubChem CID:	127327731
Reduced:	SN3O3C14H23 (1)
Stoich.:	AB3C3D14E23 (1)
Weight, g/mol:	328.156912
ΔH_f, kcal/mol:	-102.81
Dipole, Da:	3.2
IP(EA), eV:	-9.26(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-[3-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]sulfonylmorpholine

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2CCN(C2)S(=O)(=O)CC3CCCCO3

DOS

IR

Vibrations