Geometry & MOs

Info

ID:	381274
PubChem CID:	134971958
Reduced:	O2F3C14H21 (1)
Stoich.:	A2B3C14D21 (1)
Weight, g/mol:	371.9031
ΔH_f, kcal/mol:	-275.58
Dipole, Da:	3.68
IP(EA), eV:	-9.93(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,4-dibromo-5-(hydroxymethyl)-7,7-dimethoxybicyclo[2.2.1]heptane-2,3-dione

Drug info:

PubChemData

Smile

C1CCCCC(=O)OC(C/C=C/CCC1)C(F)(F)F

DOS

IR

Vibrations