Geometry & MOs

Info

ID:	387641
PubChem CID:	134986272
Reduced:	SO5C12H12 (1)
Stoich.:	AB5C12D12 (1)
Weight, g/mol:	265.972509
ΔH_f, kcal/mol:	-141.38
Dipole, Da:	2.15
IP(EA), eV:	-9.02(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl-[(E)-1,2,3-trichloro-3-(dimethylamino)prop-2-enylidene]azanium;chloride

Drug info:

PubChemData

Smile

COC(=O)C(=O)[C@]1(OCCS1=O)C2=CC=CC=C2

DOS

IR

Vibrations