Geometry & MOs

Info

ID:	371980
PubChem CID:	131283791
Reduced:	SCl2N2O2H6C8 (1)
Stoich.:	AB2C2D2E6F8 (1)
Weight, g/mol:	263.952704
ΔH_f, kcal/mol:	-29.53
Dipole, Da:	3.44
IP(EA), eV:	-10.37(-1.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(aminomethyl)-4-chloro-3-cyanobenzenesulfonyl chloride

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1C#N)CN)S(=O)(=O)Cl)Cl

DOS

IR

Vibrations