Geometry & MOs

Info

ID:	339717
PubChem CID:	127261719
Reduced:	SN2O4H12C13 (1)
Stoich.:	AB2C4D12E13 (1)
Weight, g/mol:	258.067428
ΔH_f, kcal/mol:	-87.81
Dipole, Da:	5.93
IP(EA), eV:	-9.81(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(benzenesulfonyl)propyl N-aminocarbamate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2OC(=O)NN

DOS

IR

Vibrations