Geometry & MOs

Info

ID:	66994
PubChem CID:	46505660
Reduced:	SN4O4C27H34 (1)
Stoich.:	AB4C4D27E34 (1)
Weight, g/mol:	513.094762
ΔH_f, kcal/mol:	-108.11
Dipole, Da:	3.96
IP(EA), eV:	-8.28(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chlorophenyl)-2-[1-(4-ethoxyphenyl)-5-oxo-2-sulfanylidene-3-(2-thiophen-2-ylethyl)imidazolidin-4-yl]acetamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CCCN3CCCCC3)C4=CC(=CC=C4)OC

DOS

IR

Vibrations