Geometry & MOs

Info

ID:	16542
PubChem CID:	472337
Reduced:	SN3O5C33H41 (1)
Stoich.:	AB3C5D33E41 (1)
Weight, g/mol:	591.276693
ΔH_f, kcal/mol:	-155.24
Dipole, Da:	6.54
IP(EA), eV:	-8.93(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclopentylmethyl)-N-[3-[(5S)-3,5-dibenzyl-2-oxoimidazolidin-1-yl]-2-hydroxypropyl]-4-methoxybenzenesulfonamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)S(=O)(=O)N(CC2CCCC2)CC(CN3[C@H](CN(C3=O)CC4=CC=CC=C4)CC5=CC=CC=C5)O

DOS

IR

Vibrations