Geometry & MOs

Info

ID:	289159
PubChem CID:	104337902
Reduced:	OF2N3C15H17 (1)
Stoich.:	AB2C3D15E17 (1)
Weight, g/mol:	285.184112
ΔH_f, kcal/mol:	-84.96
Dipole, Da:	4.78
IP(EA), eV:	-9.17(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(ethoxymethyl)-N-methyl-6-(2,4,5-trimethylphenyl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCNC1=NC(=NC(=C1)C2=C(C(=CC=C2)F)F)COCC

DOS

IR

Vibrations