Geometry & MOs

Info

ID:	202071
PubChem CID:	79624408
Reduced:	ClO4C12H13 (1)
Stoich.:	AB4C12D13 (1)
Weight, g/mol:	302.092101
ΔH_f, kcal/mol:	-151.95
Dipole, Da:	6.02
IP(EA), eV:	-9.91(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[2-chloro-4-(hydroxymethyl)-6-methoxyphenoxy]-2,2-dimethylpropanoate

Drug info:

PubChemData

Smile

CC(C)(COC1=C(C(=CC=C1)Cl)C=O)C(=O)O

DOS

IR

Vibrations