Geometry & MOs

Info

ID:	438867
PubChem CID:	135228625
Reduced:	FN2O2C25H39 (1)
Stoich.:	AB2C2D25E39 (1)
Weight, g/mol:	459.240959
ΔH_f, kcal/mol:	-153.21
Dipole, Da:	3.58
IP(EA), eV:	-9.6(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C=N/C=C/C1CCCC(C1CCC(C2CCC(CC2)NC(=O)C3CCCC=C3)O)F

DOS

IR

Vibrations