Geometry & MOs

Info

ID:	350967
PubChem CID:	127279277
Reduced:	SN2O5C15H20 (1)
Stoich.:	AB2C5D15E20 (1)
Weight, g/mol:	368.140593
ΔH_f, kcal/mol:	-161.99
Dipole, Da:	3.89
IP(EA), eV:	-8.69(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(1,3-benzodioxol-5-yl)pyrrolidin-1-yl]sulfonyl-2,6-dimethylmorpholine

Drug info:

PubChemData

Smile

C1CC(N(C1)S(=O)(=O)N2CCOCC2)C3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations