Geometry & MOs

Info

ID:	375116
PubChem CID:	131472550
Reduced:	ClFSN2O4H6C9 (1)
Stoich.:	ABCD2E4F6G9 (1)
Weight, g/mol:	353.93282
ΔH_f, kcal/mol:	-113.0
Dipole, Da:	9.35
IP(EA), eV:	-10.54(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-4-(oxolan-3-ylmethoxy)benzenesulfonyl chloride

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1OCC2=NOC=N2)F)S(=O)(=O)Cl

DOS

IR

Vibrations