Geometry & MOs

Info

ID:	174047
PubChem CID:	75715574
Reduced:	N2O5C21H24 (1)
Stoich.:	A2B5C21D24 (1)
Weight, g/mol:	352.191756
ΔH_f, kcal/mol:	-148.32
Dipole, Da:	2.87
IP(EA), eV:	-8.78(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(butylamino)-3-ethyl-1-oxopentan-2-yl]-3-chloro-N-methylbenzamide

Drug info:

PubChemData

Smile

CN(C(C1=CC2=C(C=C1)OCO2)C(=O)NC3CCCCC3)C(=O)C4=CC=CO4

DOS

IR

Vibrations