Geometry & MOs

Info

ID:	10958
PubChem CID:	109407
Reduced:	NOCl2C6H14 (2)
Stoich.:	ABC2D6E14 (2)
Weight, g/mol:	374.087539
ΔH_f, kcal/mol:	-182.68
Dipole, Da:	3.4
IP(EA), eV:	-9.86(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-chloro-2-hydroxypropyl)-[2-[(3-chloro-2-hydroxypropyl)-dimethylazaniumyl]ethyl]-dimethylazanium;dichloride

Drug info:

PubChemData

Smile

C[N+](C)(CC[N+](C)(C)CC(CCl)O)CC(CCl)O.[Cl-].[Cl-]

DOS

IR

Vibrations