Geometry & MOs

Info

ID:	196929
PubChem CID:	78897861
Reduced:	ClOF3N5H15C16 (1)
Stoich.:	ABC3D5E15F16 (1)
Weight, g/mol:	287.163377
ΔH_f, kcal/mol:	-87.61
Dipole, Da:	6.75
IP(EA), eV:	-9.02(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-methoxyphenoxy)ethyl]-N,4,6-trimethylpyrimidin-2-amine

Drug info:

PubChemData

Smile

CN(CCCOC1=CC=C(C=C1)Cl)C2=CC(=NC3=NC=NN23)C(F)(F)F

DOS

IR

Vibrations