Geometry & MOs

Info

ID:	188383
PubChem CID:	77707709
Reduced:	O3N4C22H29 (2)
Stoich.:	A3B4C22D29 (2)
Weight, g/mol:	255.100777
ΔH_f, kcal/mol:	-202.36
Dipole, Da:	4.71
IP(EA), eV:	-8.99(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(7-azabicyclo[2.2.1]heptan-2-yl)quinoxaline-2,3-dione

Drug info:

PubChemData

Smile

CCC(C(=O)NC(CC1=CC=CC=C1)C(C(C(CC2=CC=CC=C2)NC(=O)C(CC)NC(=O)N(C)CC3=C(C=CC=N3)C)O)O)NC(=O)N(C)CC4=C(C=CC=N4)C

DOS

IR

Vibrations