Geometry & MOs

Info

ID:	445956
PubChem CID:	135270021
Reduced:	SO2N5C21H21 (1)
Stoich.:	AB2C5D21E21 (1)
Weight, g/mol:	468.190989
ΔH_f, kcal/mol:	73.15
Dipole, Da:	4.12
IP(EA), eV:	-8.17(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-4-[5-methyl-6-[(2R)-3-methyl-5-phenyl-2H-1,3,4-oxadiazol-2-yl]pyrazin-2-yl]-3-(1,3-oxazol-5-yl)benzamide

Drug info:

PubChemData

Smile

CCS(=O)C1=CC=CC=C1C2=NC(=C(N(C2)C)N)C3=NN=C(O3)C4=CC=CC=C4

DOS

IR

Vibrations