Geometry & MOs

Info

ID:	288832
PubChem CID:	104326575
Reduced:	BrFOSN3H9C10 (1)
Stoich.:	ABCDE3F9G10 (1)
Weight, g/mol:	275.032476
ΔH_f, kcal/mol:	-3.4
Dipole, Da:	7.15
IP(EA), eV:	-8.55(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-(difluoromethyl)-6-ethoxy-7-fluoroquinoline

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)NC2=NN=C(S2)Br)F

DOS

IR

Vibrations