Geometry & MOs

Info

ID:	152615
PubChem CID:	56311591
Reduced:	SN3O4C20H23 (1)
Stoich.:	AB3C4D20E23 (1)
Weight, g/mol:	351.096286
ΔH_f, kcal/mol:	-105.65
Dipole, Da:	6.1
IP(EA), eV:	-8.91(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-ethylthiophen-2-yl)sulfonyl-3-(4-methoxyphenyl)pyrrolidine

Drug info:

PubChemData

Smile

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCC(C3)C4=CC=C(C=C4)OC)N(C1=O)C

DOS

IR

Vibrations