Geometry & MOs

Info

ID:	29909
PubChem CID:	838156
Reduced:	O5C18H18 (1)
Stoich.:	A5B18C18 (1)
Weight, g/mol:	296.129156
ΔH_f, kcal/mol:	-164.07
Dipole, Da:	3.33
IP(EA), eV:	-8.96(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-3-(2-methylpropanoylamino)-N-(2-methylpropyl)benzamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC(=C(C=C1)OC(=O)C2=CC=CC(=C2)C)OC

DOS

IR

Vibrations