Geometry & MOs

Info

ID:	318425
PubChem CID:	126651342
Reduced:	NBr2O2C7H9 (1)
Stoich.:	AB2C2D7E9 (1)
Weight, g/mol:	333.00259
ΔH_f, kcal/mol:	-61.82
Dipole, Da:	4.74
IP(EA), eV:	-10.27(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-3-(4-iodophenyl)-1-(oxetan-3-yl)azetidine

Drug info:

PubChemData

Smile

C[C@H]1[C@@H](CN1C(=O)O)C=C(Br)Br

DOS

IR

Vibrations