Geometry & MOs

Info

ID:	122927
PubChem CID:	50826777
Reduced:	O3N5C23H25 (1)
Stoich.:	A3B5C23D25 (1)
Weight, g/mol:	407.19574
ΔH_f, kcal/mol:	-14.89
Dipole, Da:	4.63
IP(EA), eV:	-8.84(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-[2-[methyl(phenylcarbamoyl)amino]ethyl]-1,2,4-oxadiazol-5-yl]-N-propan-2-ylbenzamide

Drug info:

PubChemData

Smile

CN(CCC1=NOC(=N1)C2=CC=C(C=C2)C(=O)N3CCCC3)C(=O)NC4=CC=CC=C4

DOS

IR

Vibrations