Geometry & MOs

Info

ID:	23491
PubChem CID:	604112
Reduced:	SSiO2N3C8H15 (1)
Stoich.:	ABC2D3E8F15 (1)
Weight, g/mol:	245.065424
ΔH_f, kcal/mol:	-96.22
Dipole, Da:	4.42
IP(EA), eV:	-9.31(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

trimethylsilyl 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetate

Drug info:

PubChemData

Smile

CN1C=NN=C1SCC(=O)O[Si](C)(C)C

DOS

IR

Vibrations