Geometry & MOs

Info

ID:	123535
PubChem CID:	50852806
Reduced:	ClOSN4C11H11 (1)
Stoich.:	ABCD4E11F11 (1)
Weight, g/mol:	369.068033
ΔH_f, kcal/mol:	21.98
Dipole, Da:	3.79
IP(EA), eV:	-8.87(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-3-[(4-fluorobenzoyl)amino]-N-pyridin-3-ylbenzamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1NC2=NC(=CS2)CC(=O)NN)Cl

DOS

IR

Vibrations