Geometry & MOs

Info

ID:	144476
PubChem CID:	53375558
Reduced:	ClNO2C8H14 (1)
Stoich.:	ABC2D8E14 (1)
Weight, g/mol:	243.125929
ΔH_f, kcal/mol:	-138.54
Dipole, Da:	6.43
IP(EA), eV:	-10.1(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl (3aS,6aS)-3,3a,4,5,6,6a-hexahydrocyclopenta[b]pyrrole-2-carboxylate

Drug info:

PubChemData

Smile

C1C[C@H]2CC(N[C@H]2C1)C(=O)O.Cl

DOS

IR

Vibrations