Geometry & MOs

Info

ID:	55316
PubChem CID:	17390044
Reduced:	FNO2H8C11 (1)
Stoich.:	ABC2D8E11 (1)
Weight, g/mol:	254.985384
ΔH_f, kcal/mol:	-74.63
Dipole, Da:	4.51
IP(EA), eV:	-9.67(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dichlorophenyl)pyrrole-2-carboxylic acid

Drug info:

PubChemData

Smile

C1=CN(C(=C1)C(=O)O)C2=CC=C(C=C2)F

DOS

IR

Vibrations