Geometry & MOs

Info

ID:	365496
PubChem CID:	127317918
Reduced:	O2N5C15H25 (1)
Stoich.:	A2B5C15D25 (1)
Weight, g/mol:	362.243024
ΔH_f, kcal/mol:	-66.56
Dipole, Da:	4.72
IP(EA), eV:	-9.5(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COCC1CCCN(C1)C(=O)NCC2=NN=C3N2CCCC3

DOS

IR

Vibrations