Geometry & MOs

Info

ID:	151285
PubChem CID:	53790985
Reduced:	ClNO8C24H28 (1)
Stoich.:	ABC8D24E28 (1)
Weight, g/mol:	166.172151
ΔH_f, kcal/mol:	-304.32
Dipole, Da:	8.07
IP(EA), eV:	-8.81(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-4-pent-1-enylcyclohexane

Drug info:

PubChemData

Smile

CC(CN1C2=CC=CC=C2C(OC(C1=O)(CC(=O)O)Cl)C3=C(C(=CC=C3)OC)OC)(CO)CO

DOS

IR

Vibrations