Geometry & MOs

Info

ID:	182876
PubChem CID:	76948624
Reduced:	N3C13H21 (1)
Stoich.:	A3B13C21 (1)
Weight, g/mol:	224.152478
ΔH_f, kcal/mol:	25.01
Dipole, Da:	3.51
IP(EA), eV:	-8.65(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3a,4,5,6,6a-hexahydro-2H-pyrrolo[2,3-c]pyrrol-1-yl(oxan-3-yl)methanone

Drug info:

PubChemData

Smile

CC1C(CNN1)CC(CC2=CC=CC=C2)N

DOS

IR

Vibrations