Geometry & MOs

Info

ID:	129263
PubChem CID:	51072096
Reduced:	NSO6C10H21 (2)
Stoich.:	ABC6D10E21 (2)
Weight, g/mol:	250.100354
ΔH_f, kcal/mol:	-528.61
Dipole, Da:	10.58
IP(EA), eV:	-9.11(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-azaniumyl-3-methylphenyl)-diethylazanium;dichloride

Drug info:

PubChemData

Smile

C1CCC2C(C1)OCCOCCOC3CCCCC3OCCOCCO2.NS(=O)(=O)O.NS(=O)(=O)O

DOS

IR

Vibrations