Geometry & MOs

Info

ID:	170955
PubChem CID:	75306557
Reduced:	OBr2N2H6C12 (1)
Stoich.:	AB2C2D6E12 (1)
Weight, g/mol:	222.092376
ΔH_f, kcal/mol:	53.09
Dipole, Da:	2.54
IP(EA), eV:	-9.86(-1.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-chlorophenyl)methyl]-3-azabicyclo[3.1.0]hexan-6-amine

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=C3C(=CC(C(=O)C3=N2)Br)Br

DOS

IR

Vibrations