Geometry & MOs

Info

ID:	174112
PubChem CID:	75725234
Reduced:	ClSN2O5C23H29 (1)
Stoich.:	ABC2D5E23F29 (1)
Weight, g/mol:	420.1452
ΔH_f, kcal/mol:	-192.79
Dipole, Da:	4.7
IP(EA), eV:	-10.08(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-2-(3-chloro-N-(2-hydroxyacetyl)anilino)-2-(4-hydroxy-3-methoxyphenyl)acetamide

Drug info:

PubChemData

Smile

CCCCCC(C(=O)NCS(=O)(=O)C1=CC=C(C=C1)C)N(C2=CC(=CC=C2)Cl)C(=O)CO

DOS

IR

Vibrations