Geometry & MOs

Info

ID:	148036
PubChem CID:	53787698
Reduced:	NO2H6C7 (2)
Stoich.:	AB2C6D7 (2)
Weight, g/mol:	239.075785
ΔH_f, kcal/mol:	-80.83
Dipole, Da:	6.23
IP(EA), eV:	-9.48(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(fluoromethyl)-1-(5-fluoro-2-methylphenyl)pyrrole-2,5-diol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC(=O)ON(C2=CC=CC=C2)C(=O)O

DOS

IR

Vibrations