Geometry & MOs

Info

ID:	313460
PubChem CID:	126614842
Reduced:	SN2O5C25H30 (1)
Stoich.:	AB2C5D25E30 (1)
Weight, g/mol:	223.1361
ΔH_f, kcal/mol:	-163.76
Dipole, Da:	6.58
IP(EA), eV:	-8.74(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dimethyl-1-(4-methylnaphthalen-1-yl)-2H-azete

Drug info:

PubChemData

Smile

CCCCOC1=CC=C(C=C1)CNC(=O)CS(=O)(=O)CC2=C(OC(=N2)C3=CC=CC=C3C)C

DOS

IR

Vibrations