Geometry & MOs

Info

ID:	377769
PubChem CID:	134223834
Reduced:	NO7C24H29 (1)
Stoich.:	AB7C24D29 (1)
Weight, g/mol:	449.164994
ΔH_f, kcal/mol:	-242.53
Dipole, Da:	17.24
IP(EA), eV:	-8.94(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6R)-7,7-difluoro-10-methoxy-9-(3-methoxycyclobutyl)oxy-2-oxo-6-propan-2-yl-6H-benzo[a]quinolizine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)[C@@H]1CC2=CC(=C(C=C2C3=CC(=O)C(=CN13)C(=O)O)OC)OCC4(COC4)COC

DOS

IR

Vibrations