Geometry & MOs

Info

ID:	27216
PubChem CID:	819742
Reduced:	NO2Cl4C12H13 (1)
Stoich.:	AB2C4D12E13 (1)
Weight, g/mol:	318.173213
ΔH_f, kcal/mol:	-116.86
Dipole, Da:	2.94
IP(EA), eV:	-9.3(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(4-methylphenyl)-1-phenyl-2-[1-[(Z)-prop-1-enyl]imidazol-2-yl]ethanol

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Cl)NC(=O)OCC(CCl)(CCl)CCl

DOS

IR

Vibrations