Geometry & MOs

Info

ID:	168314
PubChem CID:	74951132
Reduced:	O5C17H24 (1)
Stoich.:	A5B17C24 (1)
Weight, g/mol:	498.14371
ΔH_f, kcal/mol:	-183.63
Dipole, Da:	4.33
IP(EA), eV:	-8.86(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[7-bromo-4-[(4-methoxyphenyl)methoxy]-2,2-dimethyl-3a,4,5,7a-tetrahydro-1,3-benzodioxol-5-yl]oxy-tert-butyl-dimethylsilane

Drug info:

PubChemData

Smile

CC(=C)CC(C(C(=O)OC)OCC1=CC=C(C=C1)OC)OC

DOS

IR

Vibrations