Geometry & MOs

Info

ID:	121788
PubChem CID:	50781193
Reduced:	O3N6C21H28 (1)
Stoich.:	A3B6C21D28 (1)
Weight, g/mol:	357.216475
ΔH_f, kcal/mol:	-92.17
Dipole, Da:	4.62
IP(EA), eV:	-8.26(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-1-(4-ethyl-3-oxopyrido[2,3-b]pyrazin-2-yl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCN1C2=C(C=CC=N2)N=C(C1=O)N3CCC(CC3)C(=O)N4CCC(CC4)C(=O)N

DOS

IR

Vibrations