Geometry & MOs

Info

ID:	251426
PubChem CID:	103103875
Reduced:	ClO2N3C14H16 (1)
Stoich.:	AB2C3D14E16 (1)
Weight, g/mol:	319.98303
ΔH_f, kcal/mol:	-23.97
Dipole, Da:	1.52
IP(EA), eV:	-9.71(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-bromophenyl)sulfonyl-ethylamino]acetamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C(=O)C1=CC(=C(C=C1)C#CCN)Cl

DOS

IR

Vibrations