Geometry & MOs

Info

ID:	295454
PubChem CID:	117529537
Reduced:	BrN3C14H20 (1)
Stoich.:	AB3C14D20 (1)
Weight, g/mol:	211.204848
ΔH_f, kcal/mol:	32.39
Dipole, Da:	2.82
IP(EA), eV:	-8.63(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-7-(2-methylpropyl)-1,3,4,6,7,8,9,9a-octahydropyrazino[1,2-a]pyrazine

Drug info:

PubChemData

Smile

CN1CCN2CC(NCC2C1)C3=CC(=CC=C3)Br

DOS

IR

Vibrations