Geometry & MOs

Info

ID:	82552
PubChem CID:	49856171
Reduced:	NF3C7H7 (2)
Stoich.:	AB3C7D7 (2)
Weight, g/mol:	280.157563
ΔH_f, kcal/mol:	-274.35
Dipole, Da:	4.89
IP(EA), eV:	-9.32(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,5S)-N-[(4-phenoxyphenyl)methyl]-3-azabicyclo[3.1.0]hexan-6-amine

Drug info:

PubChemData

Smile

C1[C@@H]2[C@@H](C2NCC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)CN1

DOS

IR

Vibrations