Geometry & MOs

Info

ID:	155724
PubChem CID:	56367179
Reduced:	ClFO2N5H17C20 (1)
Stoich.:	ABC2D5E17F20 (1)
Weight, g/mol:	421.06372
ΔH_f, kcal/mol:	-26.76
Dipole, Da:	7.22
IP(EA), eV:	-9.02(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-5-methoxy-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]-4-propoxybenzamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1/C=C/C(=O)NCC(=O)NC2=CN=CC=C2)Cl)C3=CC=C(C=C3)F

DOS

IR

Vibrations