Geometry & MOs

Info

ID:	145949
PubChem CID:	53617821
Reduced:	SN2F3O4C12H15 (1)
Stoich.:	AB2C3D4E12F15 (1)
Weight, g/mol:	343.200825
ΔH_f, kcal/mol:	-311.9
Dipole, Da:	4.77
IP(EA), eV:	-9.64(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-phenoxyethyl)-2-[3-(1,2,4-triazol-1-ylmethyl)piperidin-1-yl]acetamide

Drug info:

PubChemData

Smile

COCCC(=O)NC1=C(C=CC(=C1)C(F)(F)F)NS(=O)(=O)C

DOS

IR

Vibrations