Geometry & MOs

Info

ID:	259487
PubChem CID:	103166642
Reduced:	BrNO2C16H28 (1)
Stoich.:	ABC2D16E28 (1)
Weight, g/mol:	259.05718
ΔH_f, kcal/mol:	-118.59
Dipole, Da:	6.59
IP(EA), eV:	-9.52(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromopiperidin-1-yl)-2-cyclobutylethanone

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC(=O)N(CCBr)C2CCCCC2

DOS

IR

Vibrations