Geometry & MOs

Info

ID:	122702
PubChem CID:	50817749
Reduced:	O2N5C25H27 (1)
Stoich.:	A2B5C25D27 (1)
Weight, g/mol:	393.18009
ΔH_f, kcal/mol:	-18.67
Dipole, Da:	7.11
IP(EA), eV:	-8.26(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-[2-[methyl(propanoyl)amino]ethyl]-1,2,4-oxadiazol-5-yl]-N-(pyridin-2-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC(=NCC2=CN=CC=C2)NC3=CC(=CC(=C3)C)C)NC(=O)C

DOS

IR

Vibrations