Geometry & MOs

Info

ID:	264368
PubChem CID:	103457771
Reduced:	ON2C14H20 (1)
Stoich.:	AB2C14D20 (1)
Weight, g/mol:	249.118735
ΔH_f, kcal/mol:	-21.34
Dipole, Da:	4.45
IP(EA), eV:	-8.88(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclohexylidene-3-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-one

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)CC(=O)C=C2CCCCC2)C

DOS

IR

Vibrations