Geometry & MOs

Info

ID:	126338
PubChem CID:	50960222
Reduced:	FOSN2C18H25 (1)
Stoich.:	ABCD2E18F25 (1)
Weight, g/mol:	355.072369
ΔH_f, kcal/mol:	-80.78
Dipole, Da:	3.38
IP(EA), eV:	-8.78(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-[4-[(5-methylfuran-2-carbonyl)amino]phenyl]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

C1C[C@H]2CN(CCCN2C1)C(=O)CCSCC3=CC=C(C=C3)F

DOS

IR

Vibrations