Geometry & MOs

Info

ID:	13569
PubChem CID:	301172
Reduced:	S4C13H22 (1)
Stoich.:	A4B13C22 (1)
Weight, g/mol:	306.060435
ΔH_f, kcal/mol:	-10.11
Dipole, Da:	3.34
IP(EA), eV:	-7.85(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,3-dithian-2-ylmethyl)-2-(2-methylprop-2-enyl)-1,3-dithiane

Drug info:

PubChemData

Smile

CC(=C)CC1(SCCCS1)CC2SCCCS2

DOS

IR

Vibrations