Geometry & MOs

Info

ID:	431322
PubChem CID:	135171393
Reduced:	O3N5C20H23 (1)
Stoich.:	A3B5C20D23 (1)
Weight, g/mol:	503.278407
ΔH_f, kcal/mol:	-41.83
Dipole, Da:	1.07
IP(EA), eV:	-8.68(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-oxo-3-piperidin-4-yloxy-7,8-dihydro-6H-naphthalen-1-yl)methyl]-7-piperidin-4-yloxy-3,4-dihydroisoquinolin-1-one

Drug info:

PubChemData

Smile

CC1=CC2=C(N=CN(C2=O)C)N=C1N3CCC(CC3)OC4=CN=C(C=C4)OC

DOS

IR

Vibrations