Geometry & MOs

Info

ID:	342834
PubChem CID:	127265997
Reduced:	FN2C5H5 (3)
Stoich.:	AB2C5D5 (3)
Weight, g/mol:	272.163711
ΔH_f, kcal/mol:	-57.79
Dipole, Da:	10.64
IP(EA), eV:	-9.44(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(methoxymethyl)-6-methyl-N-[2-(3-methylpyridin-2-yl)ethyl]pyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1=C(N=CC=C1)CCNC2=CC(=NC3=NC(=NN23)C(F)(F)F)C

DOS

IR

Vibrations