Geometry & MOs

Info

ID:	22147
PubChem CID:	596090
Reduced:	OC7H10 (2)
Stoich.:	AB7C10 (2)
Weight, g/mol:	220.14633
ΔH_f, kcal/mol:	-101.47
Dipole, Da:	1.84
IP(EA), eV:	-9.01(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2,5-di(propan-2-yl)phenyl] acetate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations