Geometry & MOs

Info

ID:	16049
PubChem CID:	458650
Reduced:	BrNO2C26H40 (1)
Stoich.:	ABC2D26E40 (1)
Weight, g/mol:	477.22424
ΔH_f, kcal/mol:	-83.41
Dipole, Da:	16.15
IP(EA), eV:	-7.99(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl-bis(6-phenoxyhexyl)azanium;bromide

Drug info:

PubChemData

Smile

C[N+](C)(CCCCCCOC1=CC=CC=C1)CCCCCCOC2=CC=CC=C2.[Br-]

DOS

IR

Vibrations