Geometry & MOs

Info

ID:	287708
PubChem CID:	104252483
Reduced:	NOC14H27 (1)
Stoich.:	ABC14D27 (1)
Weight, g/mol:	239.098
ΔH_f, kcal/mol:	-77.06
Dipole, Da:	3.28
IP(EA), eV:	-8.72(1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-methyl-2-(oxan-2-ylmethyl)-1,3-thiazol-5-yl]ethanone

Drug info:

PubChemData

Smile

CCCNC(CC1CCCCO1)C=C(C)C

DOS

IR

Vibrations