Geometry & MOs

Info

ID:	121785
PubChem CID:	50781188
Reduced:	ON3C13H16 (2)
Stoich.:	AB3C13D16 (2)
Weight, g/mol:	433.247775
ΔH_f, kcal/mol:	-17.81
Dipole, Da:	3.38
IP(EA), eV:	-8.31(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CN(CCN1C2=CC=CC(=C2)C)C(=O)C3CCN(CC3)C4=NC5=C(N=CC=C5)N(C4=O)C

DOS

IR

Vibrations