Geometry & MOs

Info

ID:	209496
PubChem CID:	80680173
Reduced:	NOBr2C13H17 (1)
Stoich.:	ABC2D13E17 (1)
Weight, g/mol:	307.09356
ΔH_f, kcal/mol:	-23.79
Dipole, Da:	2.63
IP(EA), eV:	-8.97(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidine

Drug info:

PubChemData

Smile

C1CN(CCC1Br)CCOC2=CC=C(C=C2)Br

DOS

IR

Vibrations