Geometry & MOs

Info

ID:	286296
PubChem CID:	104170001
Reduced:	NO2C9H13 (1)
Stoich.:	AB2C9D13 (1)
Weight, g/mol:	184.157563
ΔH_f, kcal/mol:	-55.49
Dipole, Da:	2.21
IP(EA), eV:	-9.26(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aS,6aS)-5-(2-methoxypropyl)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole

Drug info:

PubChemData

Smile

CC(COC1=CN=CC=C1)OC

DOS

IR

Vibrations