Geometry & MOs

Info

ID:	321501
PubChem CID:	126666446
Reduced:	ClN4O4H19C21 (1)
Stoich.:	AB4C4D19E21 (1)
Weight, g/mol:	255.1987
ΔH_f, kcal/mol:	-75.4
Dipole, Da:	3.36
IP(EA), eV:	-9.09(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-butyl-3,4,5,6-tetramethylnaphthalen-1-amine

Drug info:

PubChemData

Smile

COC1=CC2=NC=CC(=C2C=C1C(=O)N)OC3=CC=C(C=C3)NC(=O)NC4CC4Cl

DOS

IR

Vibrations