Geometry & MOs

Info

ID:	20611
PubChem CID:	584838
Reduced:	F2O2C17H18 (1)
Stoich.:	A2B2C17D18 (1)
Weight, g/mol:	292.127486
ΔH_f, kcal/mol:	-182.49
Dipole, Da:	4.37
IP(EA), eV:	-9.85(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,5-difluorophenyl) adamantane-1-carboxylate

Drug info:

PubChemData

Smile

C1C2CC3CC1CC(C2)(C3)C(=O)OC4=CC(=CC(=C4)F)F

DOS

IR

Vibrations