Geometry & MOs

Info

ID:	227042
PubChem CID:	87559876
Reduced:	O3C5H11 (2)
Stoich.:	A3B5C11 (2)
Weight, g/mol:	326.260966
ΔH_f, kcal/mol:	-293.57
Dipole, Da:	7.96
IP(EA), eV:	-10.16(0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-ditert-butyl-3,4,5-tris[(Z)-prop-1-enyl]phenol

Drug info:

PubChemData

Smile

CCCC(=O)O.C(COCCOCCO)O

DOS

IR

Vibrations