Geometry & MOs

Info

ID:	135393
PubChem CID:	51866642
Reduced:	SN2O4C20H26 (1)
Stoich.:	AB2C4D20E26 (1)
Weight, g/mol:	418.156243
ΔH_f, kcal/mol:	-114.41
Dipole, Da:	5.9
IP(EA), eV:	-8.81(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(2R)-2-phenylmorpholin-4-yl]propyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)S(=O)(=O)NCCCN2CCO[C@H](C2)C3=CC=CC=C3

DOS

IR

Vibrations