Geometry & MOs

Info

ID:	171499
PubChem CID:	75384115
Reduced:	ON6H16C17 (1)
Stoich.:	AB6C16D17 (1)
Weight, g/mol:	344.105545
ΔH_f, kcal/mol:	122.76
Dipole, Da:	3.24
IP(EA), eV:	-8.84(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[[methyl-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]amino]methyl]-1,3-thiazol-2-yl]acetamide

Drug info:

PubChemData

Smile

CN(CC1=CN=C2N1C=CC=C2)CC3=NC(=NO3)C4=CN=CC=C4

DOS

IR

Vibrations