Geometry & MOs

Info

ID:	404378
PubChem CID:	135066049
Reduced:	FC16H23 (1)
Stoich.:	AB16C23 (1)
Weight, g/mol:	290.00731
ΔH_f, kcal/mol:	-53.25
Dipole, Da:	1.76
IP(EA), eV:	-9.6(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R)-3-bromo-2-chloro-3-methyl-5-phenylpentan-1-ol

Drug info:

PubChemData

Smile

CCCCCCC/C=C(/CF)\C1=CC=CC=C1

DOS

IR

Vibrations