Geometry & MOs

Info

ID:	130886
PubChem CID:	51121532
Reduced:	O2F3N3H16C18 (1)
Stoich.:	A2B3C3D16E18 (1)
Weight, g/mol:	341.131031
ΔH_f, kcal/mol:	-153.38
Dipole, Da:	9.09
IP(EA), eV:	-9.18(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2,3-dimethylquinoxaline-6-carboxamide

Drug info:

PubChemData

Smile

CN(C1=CC=CC=C1OC)C(=O)CN2C3=CC=CC=C3N=C2C(F)(F)F

DOS

IR

Vibrations