Geometry & MOs

Info

ID:	288648
PubChem CID:	104322839
Reduced:	NSO2C16H21 (1)
Stoich.:	ABC2D16E21 (1)
Weight, g/mol:	225.172879
ΔH_f, kcal/mol:	-44.13
Dipole, Da:	5.17
IP(EA), eV:	-8.66(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(oxolan-2-yl)ethyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-4-ol

Drug info:

PubChemData

Smile

C1CC(C2C1CN(C2)CC3=CC(=CS3)C#CCCO)O

DOS

IR

Vibrations