Geometry & MOs

Info

ID:	210989
PubChem CID:	80881320
Reduced:	OCl2N3C14H15 (1)
Stoich.:	AB2C3D14E15 (1)
Weight, g/mol:	341.00251
ΔH_f, kcal/mol:	-6.61
Dipole, Da:	2.83
IP(EA), eV:	-8.93(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-iodophenoxy)-N,2-dimethylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCCNC1=NC(=CC(=N1)OC2=C(C(=CC=C2)Cl)Cl)C

DOS

IR

Vibrations