Geometry & MOs

Info

ID:	289291
PubChem CID:	104344038
Reduced:	ClO2N3C14H16 (1)
Stoich.:	AB2C3D14E16 (1)
Weight, g/mol:	287.163377
ΔH_f, kcal/mol:	-29.39
Dipole, Da:	1.59
IP(EA), eV:	-9.27(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3,5-dimethylphenoxy)-2-(ethoxymethyl)-N-methylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCOCC1=NC(=CC(=N1)OC2=CC=CC=C2Cl)NC

DOS

IR

Vibrations