Geometry & MOs

Info

ID:	448679
PubChem CID:	135292765
Reduced:	NCl2C14H19 (1)
Stoich.:	AB2C14D19 (1)
Weight, g/mol:	193.070306
ΔH_f, kcal/mol:	-17.33
Dipole, Da:	2.36
IP(EA), eV:	-8.78(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3,4-difluorophenyl)-3-azatricyclo[3.1.0.02,6]hexane

Drug info:

PubChemData

Smile

C[C@H]1CN(C[C@@H]1C2=CC(=C(C=C2)Cl)Cl)C(C)C

DOS

IR

Vibrations