Geometry & MOs

Info

ID:	380881
PubChem CID:	134971464
Reduced:	OBr2C28H40 (1)
Stoich.:	AB2C28D40 (1)
Weight, g/mol:	568.13746
ΔH_f, kcal/mol:	-78.8
Dipole, Da:	4.6
IP(EA), eV:	-9.07(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-dibromo-2-(3-methoxyphenyl)-3-pentadecylphenol

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCC1=C(C(=C(C=C1Br)Br)O)C2=CC=C(C=C2)C

DOS

IR

Vibrations