Geometry & MOs

Info

ID:	41724
PubChem CID:	8146970
Reduced:	FSO3N4H17C19 (1)
Stoich.:	ABC3D4E17F19 (1)
Weight, g/mol:	351.169525
ΔH_f, kcal/mol:	-55.25
Dipole, Da:	4.09
IP(EA), eV:	-8.97(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methyl-5-propan-2-ylphenoxy)-N-[4-(tetrazol-1-yl)phenyl]acetamide

Drug info:

PubChemData

Smile

CC1=NN=C(N(C1=O)N)SCC2=CC(=CC3=C2O[C@@H](OC3)C4=CC=CC=C4)F

DOS

IR

Vibrations