Geometry & MOs

Info

ID:	147566
PubChem CID:	53787222
Reduced:	ClNSO4H14C15 (1)
Stoich.:	ABCD4E14F15 (1)
Weight, g/mol:	290.180129
ΔH_f, kcal/mol:	-92.37
Dipole, Da:	4.98
IP(EA), eV:	-8.79(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(2-chloroethenyl)cyclohexyl]-4-pentylbenzene

Drug info:

PubChemData

Smile

COC=C(C1=C(C=CC(=C1)Cl)OCC2=CN=CS2)C(=O)OC

DOS

IR

Vibrations