Geometry & MOs

Info

ID:	289247
PubChem CID:	104341639
Reduced:	FON4C15H19 (1)
Stoich.:	ABC4D15E19 (1)
Weight, g/mol:	273.15896
ΔH_f, kcal/mol:	-35.43
Dipole, Da:	5.62
IP(EA), eV:	-8.85(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(methoxymethyl)-6-N-methyl-4-N-[(6-methylpyridin-3-yl)methyl]pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1F)N(C)C2=NC(=NC(=C2)N)COC

DOS

IR

Vibrations