Geometry & MOs

Info

ID:	372641
PubChem CID:	131301365
Reduced:	SO2N3C10H15 (1)
Stoich.:	AB2C3D10E15 (1)
Weight, g/mol:	274.976755
ΔH_f, kcal/mol:	21.12
Dipole, Da:	5.54
IP(EA), eV:	-9.09(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(aminomethyl)-6-cyano-3-nitrobenzenesulfonyl chloride

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=C(S1)[N+](=O)[O-])N2CCNCC2

DOS

IR

Vibrations