Geometry & MOs

Info

ID:	240542
PubChem CID:	93581339
Reduced:	ClNSO6C26H28 (1)
Stoich.:	ABCD6E26F28 (1)
Weight, g/mol:	306.080491
ΔH_f, kcal/mol:	-188.48
Dipole, Da:	3.4
IP(EA), eV:	-9.18(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-4-chloro-N-ethyl-N-[(2R)-1-methoxypropan-2-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC(=O)C1=CC=CC=C1OC[C@@H](CN(CC2=CC=C(O2)C3=CC(=CC=C3)Cl)[C@@H]4CCS(=O)(=O)C4)O

DOS

IR

Vibrations