Geometry & MOs

Info

ID:	181200
PubChem CID:	76715713
Reduced:	FSN2O5C34H37 (1)
Stoich.:	ABC2D5E34F37 (1)
Weight, g/mol:	566.278072
ΔH_f, kcal/mol:	-172.57
Dipole, Da:	6.15
IP(EA), eV:	-9.5(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

14-benzyl-2,15-dioxo-18-quinolin-4-yloxy-16-azatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid

Drug info:

PubChemData

Smile

C1CCC=CC2CC2(CC(=O)C3CC(CN3C(=O)C(CC1)CCC4=CC=CC=C4)OC5=NC6=C(S5)C=C(C=C6)F)C(=O)O

DOS

IR

Vibrations