Geometry & MOs

Info

ID:	427093
PubChem CID:	135155448
Reduced:	N2F3O4C22H27 (1)
Stoich.:	A2B3C4D22E27 (1)
Weight, g/mol:	326.199428
ΔH_f, kcal/mol:	-294.76
Dipole, Da:	2.97
IP(EA), eV:	-8.76(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C(C=C2C(=C1)C3=C(CCC3)C=N2)OCCCN4CCCC4.C(=O)(C(F)(F)F)O

DOS

IR

Vibrations