Geometry & MOs

Info

ID:	378986
PubChem CID:	134228769
Reduced:	FO3N4C19H27 (1)
Stoich.:	AB3C4D19E27 (1)
Weight, g/mol:	394.165248
ΔH_f, kcal/mol:	-114.33
Dipole, Da:	1.97
IP(EA), eV:	-9.28(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[5-fluoro-2-(4-methyl-5-oxotetrazol-1-yl)-4-propan-2-ylphenoxy]oxan-3-yl] acetate

Drug info:

PubChemData

Smile

CCCCC(C)C1=CC(=C(C=C1F)OC2CCOCC2)N3C(=O)N(N=N3)C

DOS

IR

Vibrations