Geometry & MOs

Info

ID:	377814
PubChem CID:	134223879
Reduced:	NO5C25H31 (1)
Stoich.:	AB5C25D31 (1)
Weight, g/mol:	397.188923
ΔH_f, kcal/mol:	-190.25
Dipole, Da:	11.94
IP(EA), eV:	-8.63(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-cyclopentyloxy-10-methoxy-2-oxo-6-propan-2-yl-6,7-dihydrobenzo[a]quinolizine-3-carboxylic acid

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN2[C@@H](CC3=CC(=C(C=C3C2=CC1=O)OC)OC4CCCC4)C(C)C

DOS

IR

Vibrations