Geometry & MOs

Info

ID:	353174
PubChem CID:	127284354
Reduced:	SO3N4C15H24 (1)
Stoich.:	AB3C4D15E24 (1)
Weight, g/mol:	372.190989
ΔH_f, kcal/mol:	-100.02
Dipole, Da:	2.2
IP(EA), eV:	-8.72(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)propan-2-yl]-3-(1,3,4-trimethyl-6-oxo-2H-pyrazolo[3,4-b]pyridin-5-yl)propanamide

Drug info:

PubChemData

Smile

CC1=NC(=NO1)C(C)(C)NC(=O)CSCC(=O)N2CCCCC2

DOS

IR

Vibrations