Geometry & MOs

Info

ID:	377965
PubChem CID:	134224032
Reduced:	ClNOC18H22 (1)
Stoich.:	ABCD18E22 (1)
Weight, g/mol:	427.199488
ΔH_f, kcal/mol:	-21.82
Dipole, Da:	0.34
IP(EA), eV:	-8.99(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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(CC1=CC(=C(C=C1)Cl)OCC2=CC=CC=C2)N

DOS

IR

Vibrations