Geometry & MOs

Info

ID:	435216
PubChem CID:	135184816
Reduced:	FOC13H19 (1)
Stoich.:	ABC13D19 (1)
Weight, g/mol:	206.167065
ΔH_f, kcal/mol:	-111.07
Dipole, Da:	1.92
IP(EA), eV:	-9.35(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-4-ethyl-3-phenylhexan-2-ol

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)[C@@H]([C@H](C)O)C(C)C

DOS

IR

Vibrations