Geometry & MOs

Info

ID:	54629
PubChem CID:	17389011
Reduced:	N3O5H13C16 (1)
Stoich.:	A3B5C13D16 (1)
Weight, g/mol:	341.064785
ΔH_f, kcal/mol:	-77.93
Dipole, Da:	8.93
IP(EA), eV:	-8.63(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2'-amino-7'-methyl-3'-nitrospiro[1H-indole-3,4'-pyrano[4,3-b]pyran]-2,5'-dione

Drug info:

PubChemData

Smile

C1CC2=C(C(=O)C1)C3(C4=CC=CC=C4NC3=O)C(=C(O2)N)[N+](=O)[O-]

DOS

IR

Vibrations