Geometry & MOs

Info

ID:	210854
PubChem CID:	80863537
Reduced:	FON5C12H14 (1)
Stoich.:	ABC5D12E14 (1)
Weight, g/mol:	243.137162
ΔH_f, kcal/mol:	-1.85
Dipole, Da:	3.18
IP(EA), eV:	-9.14(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3,4-dimethylphenoxy)-N-ethylpyrimidin-2-amine

Drug info:

PubChemData

Smile

CNC1=NC(=NC(=N1)OC2=CC=CC=C2F)N(C)C

DOS

IR

Vibrations