Geometry & MOs

Info

ID:	156338
PubChem CID:	56370181
Reduced:	NO4C24H31 (1)
Stoich.:	AB4C24D31 (1)
Weight, g/mol:	487.14705
ΔH_f, kcal/mol:	-132.78
Dipole, Da:	5.66
IP(EA), eV:	-8.17(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(2-bromo-4-methylphenoxy)propanoylamino]-N-(3-pyrrolidin-1-ylphenyl)butanamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CCC2CCCCN2C(=O)COCC3=CC=CC=C3)OC

DOS

IR

Vibrations