Geometry & MOs

Info

ID:	412016
PubChem CID:	135084879
Reduced:	NC10H13 (4)
Stoich.:	AB10C13 (4)
Weight, g/mol:	890.882857
ΔH_f, kcal/mol:	78.17
Dipole, Da:	2.79
IP(EA), eV:	-8.2(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl(trioctyl)azanium;tris-decyl(methyl)azanium;dichloride

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)[C@H](C2=CC=CC=N2)N(C)C3CCCCC3N(C)[C@H](C4=CC=C(C=C4)C(C)(C)C)C5=CC=CC=N5

DOS

IR

Vibrations