Geometry & MOs

Info

ID:	49103
PubChem CID:	11528713
Reduced:	FN2H13C14 (1)
Stoich.:	AB2C13D14 (1)
Weight, g/mol:	228.137497
ΔH_f, kcal/mol:	22.36
Dipole, Da:	1.5
IP(EA), eV:	-8.13(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,5R)-6-(azidomethyl)-3-benzyl-3-azabicyclo[3.1.0]hexane

Drug info:

PubChemData

Smile

C1C/C(=C\N2CC=CN=C2)/C3=C1C=C(C=C3)F

DOS

IR

Vibrations