Geometry & MOs

Info

ID:	344038
PubChem CID:	127267214
Reduced:	ON3C8H9 (2)
Stoich.:	AB3C8D9 (2)
Weight, g/mol:	323.02694
ΔH_f, kcal/mol:	28.72
Dipole, Da:	5.69
IP(EA), eV:	-9.62(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromo-5-cyanophenyl)-4-hydroxypiperidine-1-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1=NN=C(C=C1)NC(=O)N(CC2=CC=NC=C2)C3CC3

DOS

IR

Vibrations