Geometry & MOs

Info

ID:	16634
PubChem CID:	474065
Reduced:	OSCl2N3C20H21 (1)
Stoich.:	ABC2D3E20F21 (1)
Weight, g/mol:	421.078239
ΔH_f, kcal/mol:	1.85
Dipole, Da:	2.49
IP(EA), eV:	-9.06(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-(3,5-dichlorophenyl)sulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]ethanol

Drug info:

PubChemData

Smile

CC(C)C1=C(N(C(=N1)CCO)CC2=CC=NC=C2)SC3=CC(=CC(=C3)Cl)Cl

DOS

IR

Vibrations