Geometry & MOs

Info

ID:	233283
PubChem CID:	89649784
Reduced:	NO2C16H17 (1)
Stoich.:	AB2C16D17 (1)
Weight, g/mol:	760.22733
ΔH_f, kcal/mol:	-59.48
Dipole, Da:	6.05
IP(EA), eV:	-9.07(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

13,15-dibromo-5,11-didodecyl-5,11-diazatetracyclo[7.3.2.23,7.02,8]hexadeca-1(13),2(8),3(16),7(15),9(14)-pentaene-4,6,10,12-tetrone

Drug info:

PubChemData

Smile

CC(C)C1=C(C(=C(C=C1)C(=O)O)N)C2=CC=CC=C2

DOS

IR

Vibrations