Geometry & MOs

Info

ID:	57676
PubChem CID:	22432102
Reduced:	ON2H7C8 (2)
Stoich.:	AB2C7D8 (2)
Weight, g/mol:	294.111676
ΔH_f, kcal/mol:	34.6
Dipole, Da:	2.92
IP(EA), eV:	-9.68(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methylphenyl)methyl]-5-pyridin-4-yl-1,3,4-oxadiazole-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCNC(=O)C2=NN=C(O2)C3=CC=NC=C3

DOS

IR

Vibrations