Geometry & MOs

Info

ID:	404948
PubChem CID:	135071845
Reduced:	N6O7H34C41 (1)
Stoich.:	A6B7C34D41 (1)
Weight, g/mol:	338.178299
ΔH_f, kcal/mol:	-108.41
Dipole, Da:	6.87
IP(EA), eV:	-9.03(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-methylpropyl)-2,3-diphenylquinoxaline

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)OC[C@@H]2C(C([C@@H](O2)N3C=NC4=C3N=CN=C4N5C=NC6=CC=CC=C65)OC(=O)C7=CC=C(C=C7)C)OC(=O)C8=CC=C(C=C8)C

DOS

IR

Vibrations