Geometry & MOs

Info

ID:	400786
PubChem CID:	135049072
Reduced:	BNSO4C40H54 (1)
Stoich.:	ABCD4E40F54 (1)
Weight, g/mol:	788.19987
ΔH_f, kcal/mol:	-177.6
Dipole, Da:	3.71
IP(EA), eV:	-8.36(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tributylstannyl (3R,4R)-4-bromo-3-tributylstannyloxyhexanoate

Drug info:

PubChemData

Smile

B(C1CCCCC1)(C2CCCCC2)O/C(=C/C)/O[C@H](C3=CC=CC=C3)[C@H](C)N(CC4=CC=CC=C4)S(=O)OC5=C(C=C(C=C5C)C)C

DOS

IR

Vibrations