Geometry & MOs

Info

ID:	439126
PubChem CID:	135228891
Reduced:	NC23H31 (1)
Stoich.:	AB23C31 (1)
Weight, g/mol:	489.226371
ΔH_f, kcal/mol:	34.08
Dipole, Da:	1.28
IP(EA), eV:	-8.69(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-tert-butyl-10-methoxy-9-(6-morpholin-4-ylpyridin-3-yl)-2-oxo-6,7-dihydrobenzo[a]quinolizine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC=N/C=C(\C)/C1=C(C(CC=C1)C)C(C)CC(C)C2=CC=CC=C2

DOS

IR

Vibrations