Geometry & MOs

Info

ID:	210875
PubChem CID:	80866561
Reduced:	ON3C12H15 (1)
Stoich.:	AB3C12D15 (1)
Weight, g/mol:	288.12224
ΔH_f, kcal/mol:	1.26
Dipole, Da:	3.16
IP(EA), eV:	-8.5(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2,3-dimethylphenoxy)-N-ethyl-5-nitropyrimidin-4-amine

Drug info:

PubChemData

Smile

CCCOC1=NC(=NC2=CC=CC=C21)NC

DOS

IR

Vibrations