Geometry & MOs

Info

ID:	321156
PubChem CID:	126665061
Reduced:	BrSN2C9H23 (1)
Stoich.:	ABC2D9E23 (1)
Weight, g/mol:	275.252095
ΔH_f, kcal/mol:	-9.58
Dipole, Da:	13.82
IP(EA), eV:	-7.55(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

aminomethyl-dimethyl-(12-sulfanyldodecyl)azanium

Drug info:

PubChemData

Smile

C[N+](C)(CCCCCN)CCS.[Br-]

DOS

IR

Vibrations