Geometry & MOs

Info

ID:	10690
PubChem CID:	106733
Reduced:	OC6H11 (2)
Stoich.:	AB6C11 (2)
Weight, g/mol:	198.16198
ΔH_f, kcal/mol:	-138.36
Dipole, Da:	1.84
IP(EA), eV:	-10.41(0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,4,6-trimethylcyclohexyl)methyl acetate

Drug info:

PubChemData

Smile

CC1CC(C(C(C1)C)COC(=O)C)C

DOS

IR

Vibrations