Geometry & MOs

Info

ID:	338399
PubChem CID:	127259091
Reduced:	NCl3O3C10H10 (1)
Stoich.:	AB3C3D10E10 (1)
Weight, g/mol:	356.88345
ΔH_f, kcal/mol:	-136.59
Dipole, Da:	1.96
IP(EA), eV:	-9.28(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dibromo-6-fluoropyridin-2-yl)oxyethyl acetate

Drug info:

PubChemData

Smile

CC(=O)OC(C)(C)OC1=NC(=C(C=C1Cl)Cl)Cl

DOS

IR

Vibrations