Geometry & MOs

Info

ID:	259552
PubChem CID:	103167911
Reduced:	ClN2O2C14H21 (1)
Stoich.:	AB2C2D14E21 (1)
Weight, g/mol:	229.146664
ΔH_f, kcal/mol:	-70.24
Dipole, Da:	2.07
IP(EA), eV:	-9.19(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclobutyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanone

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC(=O)CC2=C(C(=NN2C)C)Cl

DOS

IR

Vibrations