Geometry & MOs

Info

ID:	149455
PubChem CID:	53789128
Reduced:	ClFNO3H5C10 (1)
Stoich.:	ABCD3E5F10 (1)
Weight, g/mol:	399.73185
ΔH_f, kcal/mol:	-63.82
Dipole, Da:	6.14
IP(EA), eV:	-9.78(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1,2,6-tetrabromocyclohexane

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)Cl)C(=O)C(=O)C=C(N2F)O

DOS

IR

Vibrations