Geometry & MOs

Info

ID:	152887
PubChem CID:	56311973
Reduced:	NSO5C20H23 (1)
Stoich.:	ABC5D20E23 (1)
Weight, g/mol:	388.145678
ΔH_f, kcal/mol:	-147.75
Dipole, Da:	9.36
IP(EA), eV:	-8.77(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[3-(4-methoxyphenyl)pyrrolidin-1-yl]sulfonyl-4-methylphenyl]acetamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2CCN(C2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

DOS

IR

Vibrations