Geometry & MOs

Info

ID:	412385
PubChem CID:	135085276
Reduced:	BOSiN3F4C29H34 (1)
Stoich.:	ABCD3E4F29G34 (1)
Weight, g/mol:	468.247114
ΔH_f, kcal/mol:	-337.39
Dipole, Da:	12.71
IP(EA), eV:	-9.26(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(5R)-2-benzyl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-4-ium-5-yl]methoxy-tert-butyl-diphenylsilane

Drug info:

PubChemData

Smile

[B-](F)(F)(F)F.CC(C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OC[C@H]3CCC4=NN(C=[N+]34)CC5=CC=CC=C5

DOS

IR

Vibrations