Geometry & MOs

Info

ID:	404704
PubChem CID:	135069687
Reduced:	O2C27H42 (1)
Stoich.:	A2B27C42 (1)
Weight, g/mol:	524.260919
ΔH_f, kcal/mol:	-124.73
Dipole, Da:	2.44
IP(EA), eV:	-8.33(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-ditert-butyl-4-[diethylphosphoryl(diphenylphosphoryl)methyl]phenol

Drug info:

PubChemData

Smile

CC(C)C(=O)C12[C@H]3CCC1(C(CC(=C2OC3(C)C)CC=C(C)C)CC=C(C)C)C

DOS

IR

Vibrations