Geometry & MOs

Info

ID:	258040
PubChem CID:	103150226
Reduced:	OF3N3C12H16 (1)
Stoich.:	AB3C3D12E16 (1)
Weight, g/mol:	319.096618
ΔH_f, kcal/mol:	-181.42
Dipole, Da:	7.59
IP(EA), eV:	-9.81(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-6-methyl-2-[2-(2,2,2-trifluoroethoxy)ethyl]thieno[2,3-d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

C1CC(C2=CN=C(N=C2C1)CCOCC(F)(F)F)N

DOS

IR

Vibrations