Geometry & MOs

Info

ID:	438785
PubChem CID:	135228542
Reduced:	NO2C13H15 (2)
Stoich.:	AB2C13D15 (2)
Weight, g/mol:	490.246772
ΔH_f, kcal/mol:	-132.44
Dipole, Da:	16.52
IP(EA), eV:	-8.96(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 6-tert-butyl-10-methoxy-2-oxo-9-(6-oxo-1-propan-2-ylpyridin-3-yl)-6,7-dihydrobenzo[a]quinolizine-3-carboxylate

Drug info:

PubChemData

Smile

C/C(=C/C(=C(\C=C)/C1=C(C=C2C(=C1)CC(N3C2=CC(=O)C(=C3)C(=O)O)C(C)(C)C)O)/C)/N

DOS

IR

Vibrations