Geometry & MOs

Info

ID:	427064
PubChem CID:	135155289
Reduced:	SN3F5O7C35H42 (1)
Stoich.:	AB3C5D7E35F42 (1)
Weight, g/mol:	360.160456
ΔH_f, kcal/mol:	-517.5
Dipole, Da:	18.6
IP(EA), eV:	-9.36(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-8-methoxy-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinoline

Drug info:

PubChemData

Smile

CCCCOC1=CC=CC(=C1)C(C(C(=O)N2CCC(CC2)N)NS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)OC5CCCC5)(F)F.C(=O)(C(F)(F)F)O

DOS

IR

Vibrations