Geometry & MOs

Info

ID:	146233
PubChem CID:	53655968
Reduced:	BrO2H17C18 (1)
Stoich.:	AB2C17D18 (1)
Weight, g/mol:	315.215806
ΔH_f, kcal/mol:	7.3
Dipole, Da:	2.72
IP(EA), eV:	-8.85(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(2S)-1-[methoxy(methyl)amino]-1-oxo-3-piperidin-4-ylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CCC(C)(C#CC1=CC=C(C=C1)OC2=CC=CC=C2Br)O

DOS

IR

Vibrations