Geometry & MOs

Info

ID:	230624
PubChem CID:	87571503
Reduced:	O3C5Si5H15 (1)
Stoich.:	A3B5C5D15 (1)
Weight, g/mol:	605.146584
ΔH_f, kcal/mol:	-172.13
Dipole, Da:	0.71
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.753841
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[[2-[[2-(4-cyclopropylsulfonylphenyl)-2-(2,4-difluorophenoxy)acetyl]amino]-1,3-thiazol-5-yl]methyl]pyrrolidine-2-carboxylate

Drug info:

PubChemData

Smile

C[Si]O[Si](C)O[Si](C)[Si](C)(C)O[Si]

DOS

IR

Vibrations