Geometry & MOs

Info

ID:	2847
PubChem CID:	8710
Reduced:	OC12H22 (1)
Stoich.:	AB12C22 (1)
Weight, g/mol:	182.167065
ΔH_f, kcal/mol:	-87.75
Dipole, Da:	3.1
IP(EA), eV:	-9.77(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-heptylcyclopentan-1-one

Drug info:

PubChemData

Smile

CCCCCCCC1CCCC1=O

DOS

IR

Vibrations