Geometry & MOs

Info

ID:	45745
PubChem CID:	10517252
Reduced:	O2N3C16H19 (1)
Stoich.:	A2B3C16D19 (1)
Weight, g/mol:	285.114713
ΔH_f, kcal/mol:	-31.24
Dipole, Da:	5.25
IP(EA), eV:	-9.04(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-[2-(4-sulfamoylphenyl)ethyl]butanamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N)NCC1=CC=C(C=C1)OCC2=CC=CC=N2

DOS

IR

Vibrations