Geometry & MOs

Info

ID:	342019
PubChem CID:	127264712
Reduced:	SN2O4C16H26 (1)
Stoich.:	AB2C4D16E26 (1)
Weight, g/mol:	327.140533
ΔH_f, kcal/mol:	-155.25
Dipole, Da:	7.31
IP(EA), eV:	-8.85(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-butyl-5-[(7-ethyl-1H-indol-3-yl)methylidene]-2-sulfanylideneimidazolidin-4-one

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)OC)S(=O)(=O)NC2CCCN(C2)CCOC

DOS

IR

Vibrations