Geometry & MOs

Info

ID:	147463
PubChem CID:	53787119
Reduced:	O5C39H70 (1)
Stoich.:	A5B39C70 (1)
Weight, g/mol:	175.048942
ΔH_f, kcal/mol:	-312.24
Dipole, Da:	4.39
IP(EA), eV:	-9.09(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,4,6-tetramethyl-4H-1,3,5-dithiazine

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)C)OCCCCCCCCC=CCC=CCC=CCC

DOS

IR

Vibrations