Geometry & MOs

Info

ID:	11097
PubChem CID:	110902
Reduced:	O2C11H20 (1)
Stoich.:	A2B11C20 (1)
Weight, g/mol:	184.14633
ΔH_f, kcal/mol:	-133.53
Dipole, Da:	1.75
IP(EA), eV:	-10.36(1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butan-2-yl cyclohexanecarboxylate

Drug info:

PubChemData

Smile

CCC(C)OC(=O)C1CCCCC1

DOS

IR

Vibrations