Geometry & MOs

Info

ID:	340883
PubChem CID:	127263318
Reduced:	NO2C6H9 (1)
Stoich.:	AB2C6D9 (1)
Weight, g/mol:	212.156501
ΔH_f, kcal/mol:	-84.87
Dipole, Da:	2.39
IP(EA), eV:	-9.93(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-butyl-2,3-dimethylnaphthalene

Drug info:

PubChemData

Smile

C[C@]1(CCC(=O)N1)C=O

DOS

IR

Vibrations