Geometry & MOs

Info

ID:	210988
PubChem CID:	80881319
Reduced:	OCl2N3C13H13 (1)
Stoich.:	AB2C3D13E13 (1)
Weight, g/mol:	311.059217
ΔH_f, kcal/mol:	3.92
Dipole, Da:	4.14
IP(EA), eV:	-9.22(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,3-dichlorophenoxy)-6-methyl-N-propylpyrimidin-2-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations