Geometry & MOs

Info

ID:	439121
PubChem CID:	135228885
Reduced:	NC27H37 (1)
Stoich.:	AB27C37 (1)
Weight, g/mol:	546.28422
ΔH_f, kcal/mol:	10.94
Dipole, Da:	1.42
IP(EA), eV:	-9.02(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[6-[2-acetamidoethyl(propyl)amino]pyridin-3-yl]-6-tert-butyl-10-methoxy-2-oxo-6,7-dihydrobenzo[a]quinolizine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC=N/C=C(\C)/C1=CC=CC=C1C(C)CC(C)C2=CC=CC(=C2)CC(C)(C)C

DOS

IR

Vibrations