Geometry & MOs

Info

ID:	265235
PubChem CID:	103513924
Reduced:	NF2O3C6H11 (1)
Stoich.:	AB2C3D6E11 (1)
Weight, g/mol:	236.133634
ΔH_f, kcal/mol:	-234.82
Dipole, Da:	4.33
IP(EA), eV:	-10.24(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-difluoro-1-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

COCC(CNC(=O)C(F)F)O

DOS

IR

Vibrations