Geometry & MOs

Info

ID:	405216
PubChem CID:	135073051
Reduced:	NO5C24H29 (1)
Stoich.:	AB5C24D29 (1)
Weight, g/mol:	290.13068
ΔH_f, kcal/mol:	-191.64
Dipole, Da:	3.44
IP(EA), eV:	-9.48(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[(3,4-dimethylphenyl)methyl]naphthalene-1-carboxylic acid

Drug info:

PubChemData

Smile

CCOC(=O)C(C(C1=CC=CC=C1)C(=O)N(C2=CC=CC=C2)C(C)C)C(=O)OCC

DOS

IR

Vibrations