Geometry & MOs

Info

ID:	20781
PubChem CID:	585660
Reduced:	NO2H7C8 (2)
Stoich.:	AB2C7D8 (2)
Weight, g/mol:	298.095357
ΔH_f, kcal/mol:	-72.12
Dipole, Da:	2.12
IP(EA), eV:	-9.5(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[(4-methoxycarbonylphenyl)diazenyl]benzoate

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)OC

DOS

IR

Vibrations