Geometry & MOs

Info

ID:	273824
PubChem CID:	103805236
Reduced:	ClO2F3H10C15 (1)
Stoich.:	AB2C3D10E15 (1)
Weight, g/mol:	284.099477
ΔH_f, kcal/mol:	-190.81
Dipole, Da:	4.0
IP(EA), eV:	-9.47(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-amino-4-fluorophenyl)-2-(oxolan-2-ylmethylsulfanyl)acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)CC2=CC(=C(C=C2)F)Cl)OC(F)F

DOS

IR

Vibrations