Geometry & MOs

Info

ID:	365996
PubChem CID:	127319301
Reduced:	OSN4C14H14 (1)
Stoich.:	ABC4D14E14 (1)
Weight, g/mol:	258.148061
ΔH_f, kcal/mol:	85.34
Dipole, Da:	5.28
IP(EA), eV:	-9.36(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-bicyclo[2.2.1]heptanylmethyl)-3-(pyrazol-1-ylmethyl)-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C=C(S2)C3=NC(=NO3)CN4C=CC=N4

DOS

IR

Vibrations