Geometry & MOs

Info

ID:	345032
PubChem CID:	127268792
Reduced:	SN2O4C16H30 (1)
Stoich.:	AB2C4D16E30 (1)
Weight, g/mol:	396.171893
ΔH_f, kcal/mol:	-197.01
Dipole, Da:	4.71
IP(EA), eV:	-8.9(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[1-(2,3-dihydro-1,4-benzodioxin-5-ylsulfonyl)pyrrolidin-2-yl]methyl]-2,6-dimethylmorpholine

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)CC2CCCN2S(=O)(=O)CC3CCCO3

DOS

IR

Vibrations