Geometry & MOs

Info

ID:	339269
PubChem CID:	127260648
Reduced:	OC14H20 (1)
Stoich.:	AB14C20 (1)
Weight, g/mol:	285.118735
ΔH_f, kcal/mol:	-39.22
Dipole, Da:	3.26
IP(EA), eV:	-9.41(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-2-[(2Z)-2-(3-ethyl-1,3-benzothiazol-2-ylidene)ethylidene]cyclohexan-1-one

Drug info:

PubChemData

Smile

CC1C=CCCC1/C=C\2/CCCCC2=O

DOS

IR

Vibrations