Geometry & MOs

Info

ID:	377915
PubChem CID:	134223981
Reduced:	NO6C27H35 (1)
Stoich.:	AB6C27D35 (1)
Weight, g/mol:	441.215138
ΔH_f, kcal/mol:	-207.26
Dipole, Da:	12.48
IP(EA), eV:	-8.74(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-tert-butyl-10-methoxy-9-[[1-(methoxymethyl)cyclopropyl]methoxy]-2-oxo-6,7-dihydrobenzo[a]quinolizine-3-carboxylic acid

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN2C(CC3=CC(=C(C=C3C2=CC1=O)OC)OCC4(CC4)COC)C(C)(C)C

DOS

IR

Vibrations