Geometry & MOs

Info

ID:	157551
PubChem CID:	56435669
Reduced:	O2F3N5C20H20 (1)
Stoich.:	A2B3C5D20E20 (1)
Weight, g/mol:	420.092597
ΔH_f, kcal/mol:	-111.99
Dipole, Da:	4.42
IP(EA), eV:	-9.87(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-2-[4-(thiophen-2-ylsulfonylamino)phenyl]acetamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCCNC(=O)C2=C(N(N=C2)C3=CC=CC(=C3)C(F)(F)F)C4CC4

DOS

IR

Vibrations