Geometry & MOs

Info

ID:	299151
PubChem CID:	117673194
Reduced:	NO4H27C30 (1)
Stoich.:	AB4C27D30 (1)
Weight, g/mol:	744.588155
ΔH_f, kcal/mol:	-51.1
Dipole, Da:	4.96
IP(EA), eV:	-8.47(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,11-difluoro-6,12-dimethyl-2,3,8,9-tetraoctylquinoxalino[6,5-f]quinoxaline

Drug info:

PubChemData

Smile

CC#CC1=CC(=C(C(=C1)C)C2=C(CC(C2=O)CC3=CC=CC=N3)OC(=O)C4=CC=C(C=C4)OC)C

DOS

IR

Vibrations