Geometry & MOs

Info

ID:	232700
PubChem CID:	87576746
Reduced:	NO2Cl3C18H18 (1)
Stoich.:	AB2C3D18E18 (1)
Weight, g/mol:	274.047738
ΔH_f, kcal/mol:	-49.49
Dipole, Da:	3.6
IP(EA), eV:	-9.13(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzenecarboperoxoic acid;bicyclo[2.2.0]hexa-1(4),2,5-triene-2-carboperoxoic acid

Drug info:

PubChemData

Smile

C1CC1COC2=CC=C(C=C2)C(C=O)(C3=CC(=C(C=C3)Cl)Cl)N.Cl

DOS

IR

Vibrations