Geometry & MOs

Info

ID:	404689
PubChem CID:	135069542
Reduced:	O5C26H30 (1)
Stoich.:	A5B26C30 (1)
Weight, g/mol:	256.182715
ΔH_f, kcal/mol:	-135.48
Dipole, Da:	2.55
IP(EA), eV:	-8.56(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-2-[(E)-1-phenylhex-4-en-3-ylidene]cyclohexan-1-ol

Drug info:

PubChemData

Smile

C[C@@]12CC[C@@H](O1)C([C@H]2CC3=C(C=C(C=C3)OCC4=COC=C4)OCC5=COC=C5)(C)C

DOS

IR

Vibrations