Geometry & MOs

Info

ID:	26179
PubChem CID:	640149
Reduced:	BrO3H15C16 (1)
Stoich.:	AB3C15D16 (1)
Weight, g/mol:	198.089209
ΔH_f, kcal/mol:	-55.11
Dipole, Da:	5.34
IP(EA), eV:	-8.95(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(dimethoxymethyl)-2-methoxyphenol

Drug info:

PubChemData

Smile

COC1=C(C(=C(C=C1)CC=O)Br)OCC2=CC=CC=C2

DOS

IR

Vibrations