Geometry & MOs

Info

ID:	8162
PubChem CID:	75187
Reduced:	OC5H6 (2)
Stoich.:	AB5C6 (2)
Weight, g/mol:	164.08373
ΔH_f, kcal/mol:	-81.66
Dipole, Da:	2.15
IP(EA), eV:	-9.28(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methylphenyl)methyl acetate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)COC(=O)C

DOS

IR

Vibrations