Geometry & MOs

Info

ID:	289235
PubChem CID:	104341312
Reduced:	ON4C12H22 (1)
Stoich.:	AB4C12D22 (1)
Weight, g/mol:	278.210661
ΔH_f, kcal/mol:	-39.78
Dipole, Da:	4.43
IP(EA), eV:	-8.99(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(methoxymethyl)-N-methyl-6-(4-propylpiperidin-1-yl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCCC(CC)NC1=NC(=NC(=C1)N)COC

DOS

IR

Vibrations