Geometry & MOs

Info

ID:	220400
PubChem CID:	85182401
Reduced:	O4C13H18 (2)
Stoich.:	A4B13C18 (2)
Weight, g/mol:	476.176775
ΔH_f, kcal/mol:	-362.83
Dipole, Da:	1.83
IP(EA), eV:	-9.57(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[1-(4-chlorophenyl)-4-(4-methylphenyl)imidazol-2-yl]-N-(4-methylphenyl)benzenecarboximidamide

Drug info:

PubChemData

Smile

CC1CC(C23COC(C2CCCC3C1(C)CC(C4=COC=C4)OC(=O)C)OC(=O)C)OC(=O)C

DOS

IR

Vibrations