Geometry & MOs

Info

ID:	404437
PubChem CID:	135066294
Reduced:	O2C15H22 (1)
Stoich.:	A2B15C22 (1)
Weight, g/mol:	280.094688
ΔH_f, kcal/mol:	-101.13
Dipole, Da:	1.55
IP(EA), eV:	-9.55(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[(1S)-1,2-diacetyloxyethyl]benzoate

Drug info:

PubChemData

Smile

CC(C)(C)CC[C@H](C1=CC=CC=C1)C(=O)OC

DOS

IR

Vibrations