Geometry & MOs

Info

ID:	385591
PubChem CID:	134979497
Reduced:	O2C8H11 (2)
Stoich.:	A2B8C11 (2)
Weight, g/mol:	244.219101
ΔH_f, kcal/mol:	-164.56
Dipole, Da:	2.58
IP(EA), eV:	-9.46(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R,2S)-1-methyl-2-octylcyclopropyl]benzene

Drug info:

PubChemData

Smile

C1COC(C1CCC2OCCO2)OCC3=CC=CC=C3

DOS

IR

Vibrations