Geometry & MOs

Info

ID:	21146
PubChem CID:	587339
Reduced:	ClO3H9C14 (1)
Stoich.:	AB3C9D14 (1)
Weight, g/mol:	260.024022
ΔH_f, kcal/mol:	-62.12
Dipole, Da:	6.24
IP(EA), eV:	-9.72(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-formylphenyl) 2-chlorobenzoate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)OC2=CC=C(C=C2)C=O)Cl

DOS

IR

Vibrations