Geometry & MOs

Info

ID:	66860
PubChem CID:	46505391
Reduced:	SN4O4C27H34 (1)
Stoich.:	AB4C4D27E34 (1)
Weight, g/mol:	524.245727
ΔH_f, kcal/mol:	-109.42
Dipole, Da:	7.59
IP(EA), eV:	-8.46(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(4-ethoxyphenyl)-3-[2-(4-methylpiperidin-1-yl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-methoxyphenyl)acetamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)CCN2C(C(=O)N(C2=S)C3=CC(=CC=C3)OC)CC(=O)NC4=CC=C(C=C4)OC

DOS

IR

Vibrations