Geometry & MOs

Info

ID:	287551
PubChem CID:	104246915
Reduced:	N3C17H25 (1)
Stoich.:	A3B17C25 (1)
Weight, g/mol:	205.157898
ΔH_f, kcal/mol:	5.87
Dipole, Da:	1.79
IP(EA), eV:	-8.06(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)butane-1,2-diamine

Drug info:

PubChemData

Smile

C1CC(NC1)C2CCN(CC2)C3=NC4=C(CCC4)C=C3

DOS

IR

Vibrations