Geometry & MOs

Info

ID:	445955
PubChem CID:	135270020
Reduced:	NC12H19 (1)
Stoich.:	AB12C19 (1)
Weight, g/mol:	407.141596
ΔH_f, kcal/mol:	29.19
Dipole, Da:	2.39
IP(EA), eV:	-8.86(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-ethylsulfinylphenyl)-1-methyl-5-(5-phenyl-1,3,4-oxadiazol-2-yl)-2H-pyrazin-6-amine

Drug info:

PubChemData

Smile

CCC(=NC)/C(=C/C)/C=C\C=C/C

DOS

IR

Vibrations