Geometry & MOs

Info

ID:	21125
PubChem CID:	587302
Reduced:	ClO3H15C16 (1)
Stoich.:	AB3C15D16 (1)
Weight, g/mol:	290.070972
ΔH_f, kcal/mol:	-86.07
Dipole, Da:	2.98
IP(EA), eV:	-8.74(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-propan-2-yloxyphenyl) 2-chlorobenzoate

Drug info:

PubChemData

Smile

CC(C)OC1=CC=CC=C1OC(=O)C2=CC=CC=C2Cl

DOS

IR

Vibrations