Geometry & MOs

Info

ID:	210857
PubChem CID:	80863819
Reduced:	ON3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	257.152812
ΔH_f, kcal/mol:	-6.62
Dipole, Da:	2.71
IP(EA), eV:	-8.75(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCNC1=NC(=CC(=N1)OC2=CC(=C(C=C2)C)C)C

DOS

IR

Vibrations