Geometry & MOs

Info

ID:	340281
PubChem CID:	127262292
Reduced:	ON2C22H28 (1)
Stoich.:	AB2C22D28 (1)
Weight, g/mol:	289.167794
ΔH_f, kcal/mol:	3.56
Dipole, Da:	3.13
IP(EA), eV:	-8.49(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 9-methoxy-2,3,4,6,7,11-hexahydro-1H-benzo[a]quinolizine-3-carboxylate

Drug info:

PubChemData

Smile

CN1C[C@@H](C2CCCCC2N1)C3=CC=CC=C3OCC4=CC=CC=C4

DOS

IR

Vibrations