Geometry & MOs

Info

ID:	48342
PubChem CID:	10539057
Reduced:	NO6C11H15 (1)
Stoich.:	AB6C11D15 (1)
Weight, g/mol:	257.080041
ΔH_f, kcal/mol:	-90.94
Dipole, Da:	2.63
IP(EA), eV:	-10.18(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-4-(5-methoxy-1H-indol-3-yl)pyrrole-2,5-dione

Drug info:

PubChemData

Smile

C[C@]1(O[C@@H](OO1)C2CCC(C2)C3OCOO3)C#N

DOS

IR

Vibrations