Geometry & MOs

Info

ID:	432596
PubChem CID:	135172730
Reduced:	ON3C18H25 (1)
Stoich.:	AB3C18D25 (1)
Weight, g/mol:	456.252526
ΔH_f, kcal/mol:	22.18
Dipole, Da:	2.24
IP(EA), eV:	-8.41(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5H-imidazo[5,1-a]isoindol-5-yl)-1-[1-[2-(N,3,4-trimethylanilino)acetyl]piperidin-4-yl]ethanone

Drug info:

PubChemData

Smile

C/C/1=C\NC=NC(C2=CC=CC=C12)CC(C3CCNCC3)O

DOS

IR

Vibrations