Geometry & MOs

Info

ID:	427107
PubChem CID:	135155534
Reduced:	O2F3N3C23H30 (1)
Stoich.:	A2B3C3D23E30 (1)
Weight, g/mol:	328.178693
ΔH_f, kcal/mol:	-219.17
Dipole, Da:	4.96
IP(EA), eV:	-8.09(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methoxy-7-[(1-methylpyrrolidin-3-yl)methoxy]-1,2,3,5-tetrahydrocyclopenta[c]quinolin-4-one

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations