Geometry & MOs

Info

ID:	370734
PubChem CID:	127340058
Reduced:	O2N3C15H23 (1)
Stoich.:	A2B3C15D23 (1)
Weight, g/mol:	346.179361
ΔH_f, kcal/mol:	-68.72
Dipole, Da:	2.35
IP(EA), eV:	-9.46(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-[4-(1H-pyrazol-5-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CCC(C1)OCC(=O)N2CCC(CC2)C3=CC=NN3

DOS

IR

Vibrations