Geometry & MOs

Info

ID:	146930
PubChem CID:	53773995
Reduced:	BrN7C10H14 (1)
Stoich.:	AB7C10D14 (1)
Weight, g/mol:	246.209599
ΔH_f, kcal/mol:	109.04
Dipole, Da:	6.02
IP(EA), eV:	-9.25(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-phenylhexyl)piperazine

Drug info:

PubChemData

Smile

CN=C(NCCN(C)C1=NC=C(C=N1)Br)NC#N

DOS

IR

Vibrations