Geometry & MOs

Info

ID:	325583
PubChem CID:	126684058
Reduced:	ClO2C10H10 (2)
Stoich.:	AB2C10D10 (2)
Weight, g/mol:	257.189198
ΔH_f, kcal/mol:	-144.25
Dipole, Da:	3.49
IP(EA), eV:	-9.02(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-butyl-3-(2,4,6-trimethylphenyl)imidazol-2-imine

Drug info:

PubChemData

Smile

C1C(C(CC(=O)C1COC2=CC=C(C=C2)Cl)O)COC3=CC=C(C=C3)Cl

DOS

IR

Vibrations