Geometry & MOs

Info

ID:	220501
PubChem CID:	85197620
Reduced:	N2O3H18C19 (1)
Stoich.:	A2B3C18D19 (1)
Weight, g/mol:	322.189257
ΔH_f, kcal/mol:	18.57
Dipole, Da:	11.37
IP(EA), eV:	-8.51(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-hydroxy-2-(2-hydroxypropan-2-yl)-1,2,3,11-tetramethyl-5,9-diazatetracyclo[7.2.1.03,11.05,10]dodecane-4,12-dione

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)OC)C(=C1C3=CC=CC=C3)C=C[N+](=O)[O-]

DOS

IR

Vibrations