Geometry & MOs

Info

ID:	298796
PubChem CID:	117656907
Reduced:	O3C11H14 (1)
Stoich.:	A3B11C14 (1)
Weight, g/mol:	336.066759
ΔH_f, kcal/mol:	-94.1
Dipole, Da:	2.55
IP(EA), eV:	-9.68(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 2-(4-hydroxyphenyl)sulfonyloxybenzoate

Drug info:

PubChemData

Smile

CC(C=O)/C(=C/C(=O)/C=C(/C=C)\O)/C

DOS

IR

Vibrations