Geometry & MOs

Info

ID:	385255
PubChem CID:	134978624
Reduced:	SO2C13H24 (1)
Stoich.:	AB2C13D24 (1)
Weight, g/mol:	274.124994
ΔH_f, kcal/mol:	-121.49
Dipole, Da:	0.76
IP(EA), eV:	-9.24(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

lithium;2-butyl-2-(dichloromethyl)-4,4,5,5-tetramethyl-1,3-dioxa-2-boranuidacyclopentane

Drug info:

PubChemData

Smile

CCC(CC)(CC)SC(=O)C[C@H](C(=C)C)O

DOS

IR

Vibrations