Geometry & MOs

Info

ID:	243517
PubChem CID:	99225746
Reduced:	ClION2C17H18 (1)
Stoich.:	ABCD2E17F18 (1)
Weight, g/mol:	426.11542
ΔH_f, kcal/mol:	9.58
Dipole, Da:	3.18
IP(EA), eV:	-8.22(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-[(2R)-1-(cyclopentylamino)-1-oxopropan-2-yl]-5-methoxy-4-propoxybenzamide

Drug info:

PubChemData

Smile

C[C@@H](CN(C)C1=CC=CC=C1)NC(=O)C2=C(C=C(C=C2)Cl)I

DOS

IR

Vibrations