Geometry & MOs

Info

ID:	212972
PubChem CID:	81062428
Reduced:	N3O3C14H21 (1)
Stoich.:	A3B3C14D21 (1)
Weight, g/mol:	322.065714
ΔH_f, kcal/mol:	-76.09
Dipole, Da:	0.91
IP(EA), eV:	-9.19(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-(2-ethoxyethyl)-3-N-methylbenzene-1,3-disulfonamide

Drug info:

PubChemData

Smile

CC(C)OCCN(C)C(=O)C1=CC=C(C=C1)/C(=N/O)/N

DOS

IR

Vibrations