Geometry & MOs

Info

ID:	351347
PubChem CID:	127280235
Reduced:	SO2N7C15H17 (1)
Stoich.:	AB2C7D15E17 (1)
Weight, g/mol:	276.133474
ΔH_f, kcal/mol:	59.11
Dipole, Da:	2.81
IP(EA), eV:	-9.38(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-(2H-triazol-4-yl)methanone

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CC2CCCN(C2)C(=O)C3=CSC(=N3)C4=NC=NN4

DOS

IR

Vibrations