Geometry & MOs

Info

ID:	390823
PubChem CID:	135001133
Reduced:	SO2N5H15C21 (1)
Stoich.:	AB2C5D15E21 (1)
Weight, g/mol:	208.182715
ΔH_f, kcal/mol:	126.51
Dipole, Da:	8.38
IP(EA), eV:	-9.03(-2.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-2-(cyclohexen-1-yl)oct-3-en-2-ol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC2=NN3C4=CNNC(=O)C(=C4N=C3S2)/C=C/5\C=CC=CC5=O

DOS

IR

Vibrations