Geometry & MOs

Info

ID:	438893
PubChem CID:	135228653
Reduced:	N3O3C26H29 (1)
Stoich.:	A3B3C26D29 (1)
Weight, g/mol:	464.211136
ΔH_f, kcal/mol:	-84.66
Dipole, Da:	15.06
IP(EA), eV:	-8.74(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 6-tert-butyl-9-(6-fluoro-4-methylpyridin-3-yl)-10-methoxy-2-oxo-6,7-dihydrobenzo[a]quinolizine-3-carboxylate

Drug info:

PubChemData

Smile

CC1=CC2=C(CC(N3C2=CC(=O)C(=C3)C(=O)O)C(C)(C)C)C=C1C4=CN=C(C=C4)N(C)C

DOS

IR

Vibrations