Geometry & MOs

Info

ID:	206889
PubChem CID:	80320037
Reduced:	SN2C17H32 (1)
Stoich.:	AB2C17D32 (1)
Weight, g/mol:	227.134385
ΔH_f, kcal/mol:	-29.73
Dipole, Da:	1.4
IP(EA), eV:	-8.84(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-4-methylpentan-2-ol

Drug info:

PubChemData

Smile

CCCC(C)(CC1=NC(=CS1)C(C)(C)C)CNC(C)C

DOS

IR

Vibrations