Geometry & MOs

Info

ID:	351346
PubChem CID:	127280234
Reduced:	O3N4C18H28 (1)
Stoich.:	A3B4C18D28 (1)
Weight, g/mol:	359.116444
ΔH_f, kcal/mol:	-108.47
Dipole, Da:	2.59
IP(EA), eV:	-9.45(-0.17)
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]-[2-(1H-1,2,4-triazol-5-yl)-1,3-thiazol-4-yl]methanone

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CC2CCCN(C2)C(=O)CNC(=O)CC3CCCC3

DOS

IR

Vibrations