Geometry & MOs

Info

ID:	439124
PubChem CID:	135228888
Reduced:	N3O4C23H27 (1)
Stoich.:	A3B4C23D27 (1)
Weight, g/mol:	284.225249
ΔH_f, kcal/mol:	-122.75
Dipole, Da:	13.34
IP(EA), eV:	-8.9(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-2-[(3E)-3-[(ethylideneamino)methylidene]-1,2,4,5-tetrahydroinden-1-yl]ethanamine

Drug info:

PubChemData

Smile

C/C(=C(/C=N)\C1=C(C=C2C(=C1)CC(N3C2=CC(=O)C(=C3)C(=O)O)C(C)(C)C)OC)/N

DOS

IR

Vibrations