Geometry & MOs

Info

ID:	295826
PubChem CID:	117545068
Reduced:	SN2C12H16 (1)
Stoich.:	AB2C12D16 (1)
Weight, g/mol:	247.103085
ΔH_f, kcal/mol:	26.5
Dipole, Da:	4.09
IP(EA), eV:	-9.34(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-methyl-5-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]methanol

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)CC#N)C2CCCCC2

DOS

IR

Vibrations