Geometry & MOs

Info

ID:	321179
PubChem CID:	126665107
Reduced:	BrSN2C7H19 (1)
Stoich.:	ABC2D7E19 (1)
Weight, g/mol:	163.126895
ΔH_f, kcal/mol:	-12.52
Dipole, Da:	11.12
IP(EA), eV:	-7.98(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

3-aminopropyl-dimethyl-(2-sulfanylethyl)azanium

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations