Geometry & MOs

Info

ID:	314519
PubChem CID:	126622021
Reduced:	SN2O3C16H18 (1)
Stoich.:	AB2C3D16E18 (1)
Weight, g/mol:	288.143805
ΔH_f, kcal/mol:	-70.55
Dipole, Da:	8.14
IP(EA), eV:	-8.76(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[difluoro(phenyl)methyl]phenyl]piperazine

Drug info:

PubChemData

Smile

C1CN(CCN1)C2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)O

DOS

IR

Vibrations