Geometry & MOs

Info

ID:	269522
PubChem CID:	103617834
Reduced:	SBr2N2O2C10H12 (1)
Stoich.:	AB2C2D2E10F12 (1)
Weight, g/mol:	275.126991
ΔH_f, kcal/mol:	-59.2
Dipole, Da:	4.96
IP(EA), eV:	-9.71(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-(4-cyanophenoxy)acetyl]amino]-2,2-dimethylpropanamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1=CC(=C(S1)Br)Br)C(=O)N

DOS

IR

Vibrations