Geometry & MOs

Info

ID:	142364
PubChem CID:	53021707
Reduced:	ON3C14H15 (2)
Stoich.:	AB3C14D15 (2)
Weight, g/mol:	468.227374
ΔH_f, kcal/mol:	-5.09
Dipole, Da:	4.37
IP(EA), eV:	-8.71(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(4-benzyl-3-oxopyrido[2,3-b]pyrazin-2-yl)piperidin-4-yl]-3-(2-methylphenyl)urea

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)NC(=O)NC2CCN(CC2)C3=NC4=C(N=CC=C4)N(C3=O)CC5=CC=CC=C5)C

DOS

IR

Vibrations