Geometry & MOs

Info

ID:	357942
PubChem CID:	127295442
Reduced:	O3N4C20H36 (1)
Stoich.:	A3B4C20D36 (1)
Weight, g/mol:	333.216475
ΔH_f, kcal/mol:	-145.69
Dipole, Da:	3.9
IP(EA), eV:	-8.48(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl(oxan-3-ylmethyl)amino]-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCCCC1)N2CCN(CC2)C(C)C(=O)N3CCOCC3

DOS

IR

Vibrations