Geometry & MOs

Info

ID:	445905
PubChem CID:	135269909
Reduced:	OSN5C24H29 (1)
Stoich.:	ABC5D24E29 (1)
Weight, g/mol:	475.269573
ΔH_f, kcal/mol:	53.74
Dipole, Da:	4.12
IP(EA), eV:	-8.24(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[6-amino-5-[5-(2-butan-2-ylpyridin-4-yl)-3-methyl-2H-1,3,4-oxadiazol-2-yl]-1-methyl-2H-pyrazin-3-yl]-N,N-dimethylbenzamide

Drug info:

PubChemData

Smile

CC(C)(C)SC1=CC=C(C=C1)C2=NC(=C(N(C2)C)N)C3N(N=C(O3)C4=CC=CC=C4)C

DOS

IR

Vibrations