Geometry & MOs

Info

ID:	350147
PubChem CID:	127277225
Reduced:	NS2O5C16H23 (1)
Stoich.:	AB2C5D16E23 (1)
Weight, g/mol:	375.114044
ΔH_f, kcal/mol:	-195.35
Dipole, Da:	9.14
IP(EA), eV:	-9.14(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydro-1,4-benzodioxin-5-ylsulfonyl)-2-(2-methoxyphenyl)pyrrolidine

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2CCCN2S(=O)(=O)C3CCS(=O)(=O)CC3

DOS

IR

Vibrations