Geometry & MOs

Info

ID:	377760
PubChem CID:	134223825
Reduced:	ClNO6C25H30 (1)
Stoich.:	ABC6D25E30 (1)
Weight, g/mol:	447.144865
ΔH_f, kcal/mol:	-213.22
Dipole, Da:	12.56
IP(EA), eV:	-9.09(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-chloro-9-[[3-(methoxymethyl)oxetan-3-yl]methoxy]-2-oxo-6-propan-2-yl-6,7-dihydrobenzo[a]quinolizine-3-carboxylic acid

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN2C(CC3=CC(=C(C=C3C2=CC1=O)Cl)OCC4(COC4)COC)C(C)C

DOS

IR

Vibrations