Geometry & MOs

Info

ID:	233958
PubChem CID:	92297423
Reduced:	O3H14C15 (1)
Stoich.:	A3B14C15 (1)
Weight, g/mol:	310.229666
ΔH_f, kcal/mol:	-77.08
Dipole, Da:	1.19
IP(EA), eV:	-9.46(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-ditert-butyl-4-[(1S)-1-phenylethyl]phenol

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=CC=C1)OC(=O)OC2=CC=CC=C2

DOS

IR

Vibrations