Geometry & MOs

Info

ID:	264149
PubChem CID:	103434288
Reduced:	O2C15H22 (1)
Stoich.:	A2B15C22 (1)
Weight, g/mol:	220.14633
ΔH_f, kcal/mol:	-93.86
Dipole, Da:	4.79
IP(EA), eV:	-9.04(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-methoxy-3,4-dimethylphenyl)pentan-2-one

Drug info:

PubChemData

Smile

CCCC(=O)CCC1=C(C(=C(C=C1)C)C)OC

DOS

IR

Vibrations