Geometry & MOs

Info

ID:	57295
PubChem CID:	22395604
Reduced:	H4N4O10C13 (1)
Stoich.:	A4B4C10D13 (1)
Weight, g/mol:	363.28992
ΔH_f, kcal/mol:	13.38
Dipole, Da:	9.43
IP(EA), eV:	-10.84(-3.14)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

2,3,4,5-tetratert-butyl-4-hydroxycyclohexa-2,5-diene-1-carboxylate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)C3=C(C(=C(C(=C3O2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations