Geometry & MOs

Info

ID:	123501
PubChem CID:	50850855
Reduced:	ClN2O2H9C14 (1)
Stoich.:	AB2C2D9E14 (1)
Weight, g/mol:	362.085382
ΔH_f, kcal/mol:	63.06
Dipole, Da:	9.28
IP(EA), eV:	-8.22(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxynaphthalen-1-yl)-1,3-bis(trifluoromethyl)-2H-imidazole

Drug info:

PubChemData

Smile

C1=CC(=C2NC3=C(O2)C=CC(=C3)Cl)C=CC1=CN=O

DOS

IR

Vibrations