Geometry & MOs

Info

ID:	288556
PubChem CID:	104319687
Reduced:	BrON2C15H21 (1)
Stoich.:	ABC2D15E21 (1)
Weight, g/mol:	170.141913
ΔH_f, kcal/mol:	-32.43
Dipole, Da:	4.55
IP(EA), eV:	-9.15(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC(C2C1CN(C2)C(CN)C3=CC=C(C=C3)Br)O

DOS

IR

Vibrations