Geometry & MOs

Info

ID:	206900
PubChem CID:	80321037
Reduced:	NOSC13H23 (1)
Stoich.:	ABCD13E23 (1)
Weight, g/mol:	247.103085
ΔH_f, kcal/mol:	-72.55
Dipole, Da:	1.78
IP(EA), eV:	-8.96(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-methyl-1,3-thiazol-2-yl)-1-phenylbutan-1-ol

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)CCCC(C(C)(C)C)O)C

DOS

IR

Vibrations