Geometry & MOs

Info

ID:	363606
PubChem CID:	127311685
Reduced:	O2N5C15H25 (1)
Stoich.:	A2B5C15D25 (1)
Weight, g/mol:	362.243024
ΔH_f, kcal/mol:	-60.5
Dipole, Da:	3.94
IP(EA), eV:	-9.38(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(methoxymethyl)-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

COCC1CCN(CC1)C(=O)NCC2=NN=C3N2CCCC3

DOS

IR

Vibrations