Geometry & MOs

Info

ID:	395386
PubChem CID:	135025345
Reduced:	SN3H7C11 (1)
Stoich.:	AB3C7D11 (1)
Weight, g/mol:	679.505408
ΔH_f, kcal/mol:	115.99
Dipole, Da:	2.3
IP(EA), eV:	-9.21(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[2-methyl-1-[(4R,5R)-3-[2-methyl-2-tri(propan-2-yl)silyloxypropyl]-4,5-diphenyl-4,5-dihydroimidazol-1-ium-1-yl]propan-2-yl]oxy-tri(propan-2-yl)silane

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=C(N=N2)C3=CC=CS3

DOS

IR

Vibrations