Geometry & MOs

Info

ID:	14134
PubChem CID:	405091
Reduced:	N4O8H16C21 (1)
Stoich.:	A4B8C16D21 (1)
Weight, g/mol:	452.096813
ΔH_f, kcal/mol:	-130.23
Dipole, Da:	8.09
IP(EA), eV:	-10.8(-1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7,11-bis(3-nitrophenyl)-2,4-diazaspiro[5.5]undecane-1,3,5,9-tetrone

Drug info:

PubChemData

Smile

C1C(C2(C(CC1=O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)NC(=O)NC2=O)C4=CC(=CC=C4)[N+](=O)[O-]

DOS

IR

Vibrations