Geometry & MOs

Info

ID:	365515
PubChem CID:	127317942
Reduced:	ON4C15H30 (1)
Stoich.:	AB4C15D30 (1)
Weight, g/mol:	362.243024
ΔH_f, kcal/mol:	-67.81
Dipole, Da:	4.2
IP(EA), eV:	-8.52(1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-ethoxypyrimidin-2-yl)-N-(1-ethylpiperidin-3-yl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCN1CCCC(C1)NC(=O)N2CCN(CCC2C)C

DOS

IR

Vibrations