Geometry & MOs

Info

ID:	155430
PubChem CID:	56364545
Reduced:	BrN2O2C26H33 (1)
Stoich.:	AB2C2D26E33 (1)
Weight, g/mol:	413.21147
ΔH_f, kcal/mol:	-68.32
Dipole, Da:	6.43
IP(EA), eV:	-9.27(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-4-methoxy-N-[1-oxo-1-(3-pyrrolidin-1-ylanilino)pentan-2-yl]benzamide

Drug info:

PubChemData

Smile

CCCN(C1CCN(CC1)C(=O)C2=CC=CC=C2)C(=O)CCCCC3=CC=C(C=C3)Br

DOS

IR

Vibrations