Geometry & MOs

Info

ID:	258045
PubChem CID:	103150358
Reduced:	OF3N3C11H16 (1)
Stoich.:	AB3C3D11E16 (1)
Weight, g/mol:	277.140197
ΔH_f, kcal/mol:	-194.65
Dipole, Da:	5.71
IP(EA), eV:	-9.22(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-ethyl-N,5-dimethyl-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCC1=C(C(=NC(=N1)CCOCC(F)(F)F)N)C

DOS

IR

Vibrations