Geometry & MOs

Info

ID:	288628
PubChem CID:	104322004
Reduced:	NSO4C15H19 (1)
Stoich.:	ABC4D15E19 (1)
Weight, g/mol:	297.11765
ΔH_f, kcal/mol:	-157.1
Dipole, Da:	8.61
IP(EA), eV:	-9.8(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CC3CCC(C3C2)O

DOS

IR

Vibrations