Geometry & MOs

Info

ID:	403247
PubChem CID:	135059362
Reduced:	OSiC12H20 (1)
Stoich.:	ABC12D20 (1)
Weight, g/mol:	429.96566
ΔH_f, kcal/mol:	-64.74
Dipole, Da:	1.09
IP(EA), eV:	-8.53(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S)-3-bromo-1-(4-nitrophenyl)sulfonyl-2-thiophen-3-ylpiperidine

Drug info:

PubChemData

Smile

COC1=CC=CC=C1CC[Si](C)(C)C

DOS

IR

Vibrations