Geometry & MOs

Info

ID:	49651
PubChem CID:	11533454
Reduced:	PSSiN2O6C21H35 (1)
Stoich.:	ABCD2E6F21G35 (1)
Weight, g/mol:	502.193966
ΔH_f, kcal/mol:	-385.52
Dipole, Da:	2.92
IP(EA), eV:	-8.56(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[[4-[2-(4-thiophen-3-ylphenyl)-1H-benzimidazol-4-yl]piperazin-1-yl]methyl]quinoxaline

Drug info:

PubChemData

Smile

CC1(COP(=S)(OC1C2=CC=C(C=C2)OC)NCCC[Si]34OCCN(CCO3)CCO4)C

DOS

IR

Vibrations