Geometry & MOs

Info

ID:	435316
PubChem CID:	135191178
Reduced:	NSC7H13 (1)
Stoich.:	ABC7D13 (1)
Weight, g/mol:	237.097663
ΔH_f, kcal/mol:	17.12
Dipole, Da:	0.46
IP(EA), eV:	-8.47(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3,3,3-trifluoro-2-hydroxypropan-1-one

Drug info:

PubChemData

Smile

CCSN1CC2CC2C1

DOS

IR

Vibrations