Geometry & MOs

Info

ID:	438369
PubChem CID:	135228105
Reduced:	BrSO3C9H17 (1)
Stoich.:	ABC3D9E17 (1)
Weight, g/mol:	263.082744
ΔH_f, kcal/mol:	-139.04
Dipole, Da:	4.46
IP(EA), eV:	-9.04(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(methylideneamino) 1-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]cyclopropane-1-sulfonate

Drug info:

PubChemData

Smile

CC(C)(O)OCCCC1(CC1)S(=O)Br

DOS

IR

Vibrations