Geometry & MOs

Info

ID:

377931

PubChem CID:

134223997

Reduced:

NO8C26H33 (1)

Stoich.:

AB8C26D33 (1)

Weight, g/mol:

515.251917

ΔHf, kcal/mol:

-284.75

Dipole, Da:

18.14

IP(EA), eV:

 -8.94(-1.06)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(COC)C1CC2=CC(=C(C=C2C3=CC(=O)C(=CN13)C(=O)O)OC)OCC4(COC4)COC

DOS

IR

Vibrations