Geometry & MOs

Info

ID:	55656
PubChem CID:	17395746
Reduced:	SN7C14H17 (1)
Stoich.:	AB7C14D17 (1)
Weight, g/mol:	292.088164
ΔH_f, kcal/mol:	136.78
Dipole, Da:	2.76
IP(EA), eV:	-8.51(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-3-propyl-2-sulfanylideneimidazolidin-4-one

Drug info:

PubChemData

Smile

CC1=CC(=C(N1C2=NC=NN2)C)C3=NN=C(SC3)NC4CC4

DOS

IR

Vibrations