Geometry & MOs

Info

ID:	299898
PubChem CID:	117867268
Reduced:	NO3C31H41 (1)
Stoich.:	AB3C31D41 (1)
Weight, g/mol:	620.268845
ΔH_f, kcal/mol:	-116.45
Dipole, Da:	1.58
IP(EA), eV:	-8.39(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-(3-cyclopropylphenyl)pyridin-3-yl]quinoxaline;6-[2-(3-methylphenyl)pyridin-3-yl]quinoxaline

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C2=C(C=CC3=C2C=CC(=C3)OC4CCC(CC4)C(C)(C)C)[C@](C)(CO)N

DOS

IR

Vibrations