Geometry & MOs

Info

ID:	377797
PubChem CID:	134223862
Reduced:	NO3C20H25 (1)
Stoich.:	AB3C20D25 (1)
Weight, g/mol:	427.199488
ΔH_f, kcal/mol:	-75.8
Dipole, Da:	3.74
IP(EA), eV:	-8.34(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6S)-6-tert-butyl-10-methoxy-9-(3-methoxycyclobutyl)oxy-2-oxo-6,7-dihydrobenzo[a]quinolizine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)/C(=N\CO)/CC1=CC(=C(C=C1)OC)OCC2=CC=CC=C2

DOS

IR

Vibrations