Geometry & MOs

Info

ID:	408370
PubChem CID:	135081136
Reduced:	ClSF3H8C10 (1)
Stoich.:	ABC3D8E10 (1)
Weight, g/mol:	196.065493
ΔH_f, kcal/mol:	-136.93
Dipole, Da:	5.69
IP(EA), eV:	-9.39(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S)-1-chloro-3-phenylpent-4-en-2-ol

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S/C(=C/C(F)(F)F)/Cl

DOS

IR

Vibrations