Geometry & MOs

Info

ID:	258042
PubChem CID:	103150272
Reduced:	OF2N3C10H15 (1)
Stoich.:	AB2C3D10E15 (1)
Weight, g/mol:	273.165269
ΔH_f, kcal/mol:	-130.72
Dipole, Da:	5.92
IP(EA), eV:	-9.51(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-tert-butyl-2-[2-(2,2-difluoroethoxy)ethyl]-N-methylpyrimidin-4-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations