Geometry & MOs

Info

ID:	231489
PubChem CID:	87573882
Reduced:	F2N3C20H25 (1)
Stoich.:	A2B3C20D25 (1)
Weight, g/mol:	297.00145
ΔH_f, kcal/mol:	-50.96
Dipole, Da:	4.83
IP(EA), eV:	-8.46(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-iodo-1-prop-2-ynyl-2,3-dihydroinden-1-amine

Drug info:

PubChemData

Smile

C.C1CC2CN(C1)CCN(C2)C3=CN=CC(=C3)C4=CC(=CC(=C4)F)F

DOS

IR

Vibrations