Geometry & MOs

Info

ID:	138959
PubChem CID:	52448749
Reduced:	SN4O4H14C19 (1)
Stoich.:	AB4C4D14E19 (1)
Weight, g/mol:	255.125929
ΔH_f, kcal/mol:	33.71
Dipole, Da:	7.01
IP(EA), eV:	-9.38(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=NC(=CS1)C2=CC(=CC=C2)[N+](=O)[O-])OC3=CC=CC=C3C#N

DOS

IR

Vibrations