Geometry & MOs

Info

ID:	377921
PubChem CID:	134223987
Reduced:	ClF2N3O4C23H30 (1)
Stoich.:	AB2C3D4E23F30 (1)
Weight, g/mol:	385.152537
ΔH_f, kcal/mol:	-250.57
Dipole, Da:	6.45
IP(EA), eV:	-8.93(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCCCCC(C(=O)OCC)OC1=CC=CC(=C1C)NC(=O)C2=C(N(N=C2C(F)F)C)Cl

DOS

IR

Vibrations