Geometry & MOs

Info

ID:	289158
PubChem CID:	104337743
Reduced:	OF2N3C14H15 (1)
Stoich.:	AB2C3D14E15 (1)
Weight, g/mol:	293.133969
ΔH_f, kcal/mol:	-74.29
Dipole, Da:	3.61
IP(EA), eV:	-9.27(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2,3-difluorophenyl)-2-(ethoxymethyl)-N-ethylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCOCC1=NC(=CC(=N1)NC)C2=CC(=C(C=C2)F)F

DOS

IR

Vibrations