Geometry & MOs

Info

ID:	288662
PubChem CID:	104323163
Reduced:	ClNOSC12H16 (1)
Stoich.:	ABCDE12F16 (1)
Weight, g/mol:	208.121178
ΔH_f, kcal/mol:	-32.39
Dipole, Da:	2.84
IP(EA), eV:	-9.06(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,2-oxazol-5-ylmethyl)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-4-ol

Drug info:

PubChemData

Smile

C1CC(C2C1CN(C2)CC3=CC=C(S3)Cl)O

DOS

IR

Vibrations