Geometry & MOs

Info

ID:	10959
PubChem CID:	109409
Reduced:	O2C15H26 (1)
Stoich.:	A2B15C26 (1)
Weight, g/mol:	238.19328
ΔH_f, kcal/mol:	-133.13
Dipole, Da:	2.07
IP(EA), eV:	-9.59(0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,2-dimethyl-6-methylidenecyclohexyl)butan-2-yl acetate

Drug info:

PubChemData

Smile

CC(CCC1C(=C)CCCC1(C)C)OC(=O)C

DOS

IR

Vibrations