Geometry & MOs

Info

ID:	245720
PubChem CID:	103023114
Reduced:	NO2C13H27 (1)
Stoich.:	AB2C13D27 (1)
Weight, g/mol:	256.14633
ΔH_f, kcal/mol:	-122.71
Dipole, Da:	2.06
IP(EA), eV:	-8.82(2.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(CCN1CCCCCC1CO)OC

DOS

IR

Vibrations