Geometry & MOs

Info

ID:	16626
PubChem CID:	474028
Reduced:	OSCl2N2C24H28 (1)
Stoich.:	ABC2D2E24F28 (1)
Weight, g/mol:	462.12994
ΔH_f, kcal/mol:	-25.18
Dipole, Da:	2.93
IP(EA), eV:	-8.99(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[(4-tert-butylphenyl)methyl]-5-(3,5-dichlorophenyl)sulfanyl-4-propan-2-ylimidazol-2-yl]methanol

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations