Geometry & MOs

Info

ID:	147184
PubChem CID:	53786838
Reduced:	BrCl2C11H15 (1)
Stoich.:	AB2C11D15 (1)
Weight, g/mol:	350.209324
ΔH_f, kcal/mol:	-6.88
Dipole, Da:	2.37
IP(EA), eV:	-9.35(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 2-(3,5-ditert-butyl-4-hydroxyphenyl)butanedioate

Drug info:

PubChemData

Smile

CC(=CCBr)CCC=C(C)C=C(Cl)Cl

DOS

IR

Vibrations