Geometry & MOs

Info

ID:	277241
PubChem CID:	103827444
Reduced:	O2N3H11C16 (1)
Stoich.:	A2B3C11D16 (1)
Weight, g/mol:	275.105862
ΔH_f, kcal/mol:	75.49
Dipole, Da:	4.67
IP(EA), eV:	-9.07(-2.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-benzyl-1,2,4-oxadiazol-5-yl)-3-methylbenzonitrile

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C#N)C2=NC(=C3C=CC(=O)C=C3)NO2

DOS

IR

Vibrations