Geometry & MOs

Info

ID:	211001
PubChem CID:	80882027
Reduced:	ION4C11H11 (1)
Stoich.:	ABC4D11E11 (1)
Weight, g/mol:	243.137162
ΔH_f, kcal/mol:	41.44
Dipole, Da:	3.32
IP(EA), eV:	-9.1(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-6-(2-propan-2-ylphenoxy)pyrimidin-2-amine

Drug info:

PubChemData

Smile

CNC1=CC(=NC(=N1)N)OC2=CC(=CC=C2)I

DOS

IR

Vibrations