Geometry & MOs

Info

ID:	225136
PubChem CID:	85741928
Reduced:	ON2C14H14 (1)
Stoich.:	AB2C14D14 (1)
Weight, g/mol:	166.012222
ΔH_f, kcal/mol:	72.37
Dipole, Da:	4.91
IP(EA), eV:	-9.64(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1,3-dithiane 1,1-dioxide

Drug info:

PubChemData

Smile

CC=CC(C#N)(C#N)C(CC=C)C1=CC=CO1

DOS

IR

Vibrations