Geometry & MOs

Info

ID:	121781
PubChem CID:	50781098
Reduced:	O2N4C25H28 (1)
Stoich.:	A2B4C25D28 (1)
Weight, g/mol:	457.191403
ΔH_f, kcal/mol:	-46.72
Dipole, Da:	2.71
IP(EA), eV:	-8.32(-0.77)
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-(4-fluorophenyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)NC=C2CCNC(=O)CCN3C4=C(C=C(C(=C4)C)C)N=C(C3=O)C

DOS

IR

Vibrations