Geometry & MOs

Info

ID:	377824
PubChem CID:	134223889
Reduced:	ClNO5C23H26 (1)
Stoich.:	ABC5D23E26 (1)
Weight, g/mol:	499.257003
ΔH_f, kcal/mol:	-176.17
Dipole, Da:	15.87
IP(EA), eV:	-9.32(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 10-methoxy-9-[(3-methoxycyclobutyl)methoxy]-6-(1-methoxy-2-methylpropan-2-yl)-2-oxo-6,7-dihydrobenzo[a]quinolizine-3-carboxylate

Drug info:

PubChemData

Smile

CC(C)C1CC2=CC(=C(C=C2C3=CC(=O)C(=CN13)C(=O)O)Cl)OCC4(CC4)COC

DOS

IR

Vibrations