Geometry & MOs

Info

ID:	157754
PubChem CID:	56436983
Reduced:	N2O4C19H34 (1)
Stoich.:	A2B4C19D34 (1)
Weight, g/mol:	450.162471
ΔH_f, kcal/mol:	-232.61
Dipole, Da:	1.74
IP(EA), eV:	-9.42(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-[[3-[(4-fluorophenyl)sulfamoyl]benzoyl]-methylamino]butanoate

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)N1CCCC1C(=O)N(C)CCCC(=O)OC(C)(C)C

DOS

IR

Vibrations