Geometry & MOs

Info

ID:	258044
PubChem CID:	103150323
Reduced:	OF2N3C10H15 (1)
Stoich.:	AB2C3D10E15 (1)
Weight, g/mol:	263.124547
ΔH_f, kcal/mol:	-121.73
Dipole, Da:	6.31
IP(EA), eV:	-9.15(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCNC1=NC(=NC=C1)CCOCC(F)F

DOS

IR

Vibrations