Geometry & MOs

Info

ID:	151301
PubChem CID:	53801028
Reduced:	O3C4H8 (2)
Stoich.:	A3B4C8 (2)
Weight, g/mol:	277.27695
ΔH_f, kcal/mol:	-279.67
Dipole, Da:	3.68
IP(EA), eV:	-10.39(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-hexylcyclohexyl)ethenyl]piperidine

Drug info:

PubChemData

Smile

CC(=O)OC(CO)COCC(CO)O

DOS

IR

Vibrations