Geometry & MOs

Info

ID:	377765
PubChem CID:	134223830
Reduced:	NO7C28H37 (1)
Stoich.:	AB7C28D37 (1)
Weight, g/mol:	431.149951
ΔH_f, kcal/mol:	-243.18
Dipole, Da:	13.91
IP(EA), eV:	-8.74(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-chloro-9-[(3-methoxycyclobutyl)methoxy]-2-oxo-6-propan-2-yl-6,7-dihydrobenzo[a]quinolizine-3-carboxylic acid

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN2C(CC3=CC(=C(C=C3C2=CC1=O)OC)OCC4(CC4)COC)C(C)(C)COC

DOS

IR

Vibrations