Geometry & MOs

Info

ID:	373009
PubChem CID:	131308564
Reduced:	ON3C7H9 (1)
Stoich.:	AB3C7D9 (1)
Weight, g/mol:	281.05276
ΔH_f, kcal/mol:	26.58
Dipole, Da:	8.43
IP(EA), eV:	-9.41(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1R)-1-(6-bromopyridin-3-yl)prop-2-enyl]piperazine

Drug info:

PubChemData

Smile

CCCN1C=C(C(=N1)C#N)O

DOS

IR

Vibrations