Geometry & MOs

Info

ID:	287436
PubChem CID:	104242227
Reduced:	O2C17H24 (1)
Stoich.:	A2B17C24 (1)
Weight, g/mol:	225.118735
ΔH_f, kcal/mol:	-98.64
Dipole, Da:	3.03
IP(EA), eV:	-8.47(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC(C1)C(CCCC2=CC3=C(C=C2)OCC3)O

DOS

IR

Vibrations