Geometry & MOs

Info

ID:	289295
PubChem CID:	104344227
Reduced:	IO2N3C13H14 (1)
Stoich.:	AB2C3D13E14 (1)
Weight, g/mol:	294.205576
ΔH_f, kcal/mol:	-3.76
Dipole, Da:	1.72
IP(EA), eV:	-9.4(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-(methoxymethyl)-6-(2-piperidin-1-ylethoxy)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCOCC1=NC(=CC(=N1)OC2=CC=CC=C2I)N

DOS

IR

Vibrations