Geometry & MOs

Info

ID:	134084
PubChem CID:	51639712
Reduced:	BrN2O2C12H15 (1)
Stoich.:	AB2C2D12E15 (1)
Weight, g/mol:	457.02215
ΔH_f, kcal/mol:	-72.63
Dipole, Da:	3.95
IP(EA), eV:	-9.82(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

3-[(4-bromophenyl)sulfonylamino]-N-(2-ethylphenyl)benzenecarboximidate

Drug info:

PubChemData

Smile

CCNC(=O)[C@@H](C)NC(=O)C1=CC(=CC=C1)Br

DOS

IR

Vibrations