Geometry & MOs

Info

ID:	449157
PubChem CID:	135296454
Reduced:	ON4C25H32 (1)
Stoich.:	AB4C25D32 (1)
Weight, g/mol:	556.243418
ΔH_f, kcal/mol:	17.08
Dipole, Da:	4.77
IP(EA), eV:	-8.22(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-cyano-2-oxo-1H-pyridin-3-yl)-2-formyl-4-[5-[4-(5-formylpyridin-2-yl)piperazin-1-yl]pentoxy]-N-methylbenzamide

Drug info:

PubChemData

Smile

C/C=C(\C)/CN1C2=CC=CC=C2N=C1NC3CCN(CC3)CCC4=CC=C(C=C4)O

DOS

IR

Vibrations