Geometry & MOs

Info

ID:	173203
PubChem CID:	75610570
Reduced:	BrO2N5H20C25 (1)
Stoich.:	AB2C5D20E25 (1)
Weight, g/mol:	344.129156
ΔH_f, kcal/mol:	77.65
Dipole, Da:	3.96
IP(EA), eV:	-8.59(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-chlorophenyl)methylideneamino]-2-(2-methyl-5-propan-2-ylphenoxy)acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NN(C=C2C=NNC(=O)CNC(=O)C3=CC(=CC=C3)Br)C4=CC=CC=C4

DOS

IR

Vibrations