Geometry & MOs

Info

ID:	37553
PubChem CID:	8022178
Reduced:	N2O3H18C25 (1)
Stoich.:	A2B3C18D25 (1)
Weight, g/mol:	390.157957
ΔH_f, kcal/mol:	-13.02
Dipole, Da:	3.01
IP(EA), eV:	-8.8(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-carbamoylpiperidin-1-yl)-2-oxoethyl] anthracene-9-carboxylate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=CC=CC=C1C#N)OC(=O)C2=C3C=CC=CC3=CC4=CC=CC=C42

DOS

IR

Vibrations