Geometry & MOs

Info

ID:	159894
PubChem CID:	57288864
Reduced:	F2O3C34H42 (1)
Stoich.:	A2B3C34D42 (1)
Weight, g/mol:	321.161864
ΔH_f, kcal/mol:	-150.25
Dipole, Da:	4.39
IP(EA), eV:	-9.52(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-dodecyl-1,1-bis(sulfanylidene)-1,3-thiazolidine

Drug info:

PubChemData

Smile

CCCCCCCCCC1=CC(=C(C=C1)C2=C(C=CC(=C2F)C(=O)OOCCCCCC)C3=CC=CC=C3)F

DOS

IR

Vibrations