Geometry & MOs

Info

ID:	298666
PubChem CID:	117653750
Reduced:	F3O3S3C4H9 (1)
Stoich.:	A3B3C3D4E9 (1)
Weight, g/mol:	271.113233
ΔH_f, kcal/mol:	-286.45
Dipole, Da:	2.31
IP(EA), eV:	-8.85(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(difluoromethoxy)phenyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

C(CS)CS.C(F)(F)(F)S(=O)(=O)O

DOS

IR

Vibrations