Geometry & MOs

Info

ID:	288587
PubChem CID:	104320659
Reduced:	N3O3C13H17 (1)
Stoich.:	A3B3C13D17 (1)
Weight, g/mol:	264.163791
ΔH_f, kcal/mol:	-111.93
Dipole, Da:	8.49
IP(EA), eV:	-9.29(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(1S)-1-aminoethyl]-2-fluorophenyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-4-ol

Drug info:

PubChemData

Smile

CC1=NC(=NC=C1C(=O)O)N2CC3CCC(C3C2)O

DOS

IR

Vibrations