Geometry & MOs

Info

ID:	425894
PubChem CID:	135129478
Reduced:	ClNOF3H15C17 (1)
Stoich.:	ABCD3E15F17 (1)
Weight, g/mol:	564.08236
ΔH_f, kcal/mol:	-168.09
Dipole, Da:	5.27
IP(EA), eV:	-9.01(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-[[2-chloro-6-(trifluoromethyl)benzoyl]amino]-5-(1,3-oxazolidine-3-carbonyl)pyridine-2-carboximidoyl]-3-fluorobenzoic acid

Drug info:

PubChemData

Smile

CC(C)N(C1=CC=CC=C1)C(=O)C2=C(C=CC=C2Cl)C(F)(F)F

DOS

IR

Vibrations