Geometry & MOs

Info

ID:	288632
PubChem CID:	104322063
Reduced:	NO2F3C14H14 (1)
Stoich.:	AB2C3D14E14 (1)
Weight, g/mol:	237.08235
ΔH_f, kcal/mol:	-208.12
Dipole, Da:	5.97
IP(EA), eV:	-9.71(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-hydroxy-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-thiophen-3-ylmethanone

Drug info:

PubChemData

Smile

C1CC(C2C1CN(C2)C(=O)C3=C(C(=C(C=C3)F)F)F)O

DOS

IR

Vibrations