Geometry & MOs

Info

ID:	245858
PubChem CID:	103024637
Reduced:	O3C15H22 (1)
Stoich.:	A3B15C22 (1)
Weight, g/mol:	212.087101
ΔH_f, kcal/mol:	-122.48
Dipole, Da:	2.7
IP(EA), eV:	-8.96(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-4-methyl-1-thiophen-2-ylpentan-1-one

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1C(=O)CCC(C)(C)OC

DOS

IR

Vibrations