Geometry & MOs

Info

ID:	289179
PubChem CID:	104338801
Reduced:	ON4C13H22 (1)
Stoich.:	AB4C13D22 (1)
Weight, g/mol:	278.210661
ΔH_f, kcal/mol:	-26.81
Dipole, Da:	4.84
IP(EA), eV:	-8.77(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(methoxymethyl)-6-(3-methylpiperidin-1-yl)-N-propylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1CCCCN1C2=NC(=NC(=C2)NC)COC

DOS

IR

Vibrations