Geometry & MOs

Info

ID:	282942
PubChem CID:	103947280
Reduced:	NSBr2O2H11C14 (1)
Stoich.:	ABC2D2E11F14 (1)
Weight, g/mol:	245.141579
ΔH_f, kcal/mol:	-14.91
Dipole, Da:	5.63
IP(EA), eV:	-8.76(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclobutyl-1-(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)ethanone

Drug info:

PubChemData

Smile

C1CC2=C(C(=CC=C2)O)N(C1)C(=O)C3=C(SC(=C3)Br)Br

DOS

IR

Vibrations