Geometry & MOs

Info

ID:	427082
PubChem CID:	135155392
Reduced:	N3O4C26H37 (1)
Stoich.:	A3B4C26D37 (1)
Weight, g/mol:	409.272927
ΔH_f, kcal/mol:	-138.49
Dipole, Da:	9.0
IP(EA), eV:	-8.53(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclobutylmethyl)-8-methoxy-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinolin-4-amine

Drug info:

PubChemData

Smile

COC1=C(C=C2C(=C1)C3=C(CCC3)C(=N2)NCC4CCC4)OCCCN5CCCC5.C(=O)O

DOS

IR

Vibrations