Geometry & MOs

Info

ID:	365986
PubChem CID:	127319276
Reduced:	O2N5C15H19 (1)
Stoich.:	A2B5C15D19 (1)
Weight, g/mol:	204.101111
ΔH_f, kcal/mol:	14.99
Dipole, Da:	4.12
IP(EA), eV:	-9.72(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(cyclopropylmethyl)-3-(pyrazol-1-ylmethyl)-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

C1CCC(C1)N2CC(CC2=O)C3=NC(=NO3)CN4C=CC=N4

DOS

IR

Vibrations