Geometry & MOs

Info

ID:	3450
PubChem CID:	9670
Reduced:	FINOC15H23 (1)
Stoich.:	ABCDE15F23 (1)
Weight, g/mol:	379.08084
ΔH_f, kcal/mol:	-67.34
Dipole, Da:	11.92
IP(EA), eV:	-7.44(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(4-fluorophenyl)-3-hydroxyhex-5-enyl]-trimethylazanium;iodide

Drug info:

PubChemData

Smile

C[N+](C)(C)CCC(CC=C)(C1=CC=C(C=C1)F)O.[I-]

DOS

IR

Vibrations