Geometry & MOs

Info

ID:	448779
PubChem CID:	135293550
Reduced:	F3O3N8C26H31 (1)
Stoich.:	A3B3C8D26E31 (1)
Weight, g/mol:	274.98249
ΔH_f, kcal/mol:	-191.11
Dipole, Da:	5.3
IP(EA), eV:	-8.82(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-chloro-3-piperidin-1-ylpyrazine

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCN(CC(C1)O)C2=CC=CC(=N2)NC3=CC(=NC=C3C=N)C4=CN(N=C4)CC(F)(F)F

DOS

IR

Vibrations