Geometry & MOs

Info

ID:	439051
PubChem CID:	135228814
Reduced:	ClIOC15H18 (1)
Stoich.:	ABCD15E18 (1)
Weight, g/mol:	370.152872
ΔH_f, kcal/mol:	-38.42
Dipole, Da:	3.47
IP(EA), eV:	-9.6(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-tert-butyl-9-carbamoyl-10-methoxy-2-oxo-6,7-dihydrobenzo[a]quinolizine-3-carboxylic acid

Drug info:

PubChemData

Smile

C1CCC(CC1)C(=O)CCC2=C(C=CC=C2I)Cl

DOS

IR

Vibrations