Geometry & MOs

Info

ID:	408001
PubChem CID:	135080756
Reduced:	BrSF2C7H11 (1)
Stoich.:	ABC2D7E11 (1)
Weight, g/mol:	162.069222
ΔH_f, kcal/mol:	-107.1
Dipole, Da:	3.65
IP(EA), eV:	-8.85(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

oxan-2-ylmethyl carbonofluoridate

Drug info:

PubChemData

Smile

CC(C)(C)SCC(=C(F)F)Br

DOS

IR

Vibrations