Geometry & MOs

Info

ID:	411018
PubChem CID:	135083823
Reduced:	ClNO2C6H12 (1)
Stoich.:	ABC2D6E12 (1)
Weight, g/mol:	286.99532
ΔH_f, kcal/mol:	-139.87
Dipole, Da:	6.87
IP(EA), eV:	-9.56(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (NE)-N-[1-(dimethylamino)ethylidene]carbamimidothioate;hydroiodide

Drug info:

PubChemData

Smile

CCOC(=O)/C=C(\C)/N.Cl

DOS

IR

Vibrations