Geometry & MOs

Info

ID:	20163
PubChem CID:	580545
Reduced:	ClO3H9C12 (1)
Stoich.:	AB3C9D12 (1)
Weight, g/mol:	236.024022
ΔH_f, kcal/mol:	-70.85
Dipole, Da:	2.8
IP(EA), eV:	-9.57(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chlorophenyl)methyl furan-2-carboxylate

Drug info:

PubChemData

Smile

C1=COC(=C1)C(=O)OCC2=CC=C(C=C2)Cl

DOS

IR

Vibrations