Geometry & MOs

Info

ID:	377747
PubChem CID:	134223812
Reduced:	ION2H9C10 (1)
Stoich.:	ABC2D9E10 (1)
Weight, g/mol:	413.183838
ΔH_f, kcal/mol:	46.07
Dipole, Da:	3.71
IP(EA), eV:	-9.22(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(OC=C1)C2=NC(=NC=C2C)I

DOS

IR

Vibrations