Geometry & MOs

Info

ID:	209980
PubChem CID:	80747053
Reduced:	ClO2N4C12H17 (1)
Stoich.:	AB2C4D12E17 (1)
Weight, g/mol:	265.055049
ΔH_f, kcal/mol:	-55.33
Dipole, Da:	6.93
IP(EA), eV:	-8.95(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7,8-difluoro-3,4-dihydro-1H-pyrano[4,3-b]quinoline-10-carboxylic acid

Drug info:

PubChemData

Smile

C1CC2COC(CN2C1)CNC3=C(C(=O)NN=C3)Cl

DOS

IR

Vibrations