Geometry & MOs

Info

ID:	82459
PubChem CID:	49856058
Reduced:	O3C8H11 (2)
Stoich.:	A3B8C11 (2)
Weight, g/mol:	324.157288
ΔH_f, kcal/mol:	-259.13
Dipole, Da:	6.41
IP(EA), eV:	-8.64(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-O-tert-butyl 1-O-ethyl 2-[(4-hydroxy-3-methoxyphenyl)methyl]propanedioate

Drug info:

PubChemData

Smile

CCOC(=O)C(CC1=CC(=C(C=C1)O)OC)C(=O)OC(C)C

DOS

IR

Vibrations