Geometry & MOs

Info

ID:	172339
PubChem CID:	75497137
Reduced:	F3N4C15H17 (1)
Stoich.:	A3B4C15D17 (1)
Weight, g/mol:	356.097683
ΔH_f, kcal/mol:	-100.38
Dipole, Da:	3.4
IP(EA), eV:	-9.53(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(methoxymethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-4,5-dimethylthiophene-2-sulfonamide

Drug info:

PubChemData

Smile

C1CC2=C(CC1NC(CC3=CC=NC=C3)C(F)(F)F)C=NN2

DOS

IR

Vibrations