Geometry & MOs

Info

ID:	277647
PubChem CID:	103830081
Reduced:	NO2F3H8C9 (1)
Stoich.:	AB2C3D8E9 (1)
Weight, g/mol:	251.095771
ΔH_f, kcal/mol:	-223.23
Dipole, Da:	2.77
IP(EA), eV:	-9.79(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-fluoro-2-hydroxyphenyl)-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)methanone

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1F)O)C(=O)NCC(F)F

DOS

IR

Vibrations