Geometry & MOs

Info

ID:	245710
PubChem CID:	103023066
Reduced:	NO2C11H15 (1)
Stoich.:	AB2C11D15 (1)
Weight, g/mol:	198.071451
ΔH_f, kcal/mol:	-65.71
Dipole, Da:	1.88
IP(EA), eV:	-10.02(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-3-methyl-1-thiophen-2-ylbutan-1-one

Drug info:

PubChemData

Smile

CC(C)(CC(=O)C1=CN=CC=C1)OC

DOS

IR

Vibrations