Geometry & MOs

Info

ID:	438881
PubChem CID:	135228641
Reduced:	N3O4C24H29 (1)
Stoich.:	A3B4C24D29 (1)
Weight, g/mol:	461.220223
ΔH_f, kcal/mol:	-109.57
Dipole, Da:	7.96
IP(EA), eV:	-8.23(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN2C(CC3=CC(=C(C=C3C2=CC1=O)OC)/C(=C/N)/C=NC)C(C)C

DOS

IR

Vibrations