Geometry & MOs

Info

ID:	207906
PubChem CID:	80467307
Reduced:	ON3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	287.132157
ΔH_f, kcal/mol:	-2.35
Dipole, Da:	3.79
IP(EA), eV:	-8.82(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-fluoro-5-(3-hydroxyprop-1-ynyl)phenyl]methyl]bicyclo[3.1.0]hexane-3-carboxamide

Drug info:

PubChemData

Smile

CNC(C1CC2CC2C1)C3=CC4=C(C=C3)NC(=O)N4

DOS

IR

Vibrations