Geometry & MOs

Info

ID:	335568
PubChem CID:	127254430
Reduced:	FNO6H28C36 (1)
Stoich.:	ABC6D28E36 (1)
Weight, g/mol:	240.074621
ΔH_f, kcal/mol:	-68.62
Dipole, Da:	4.37
IP(EA), eV:	-8.78(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(5-methoxy-4-oxo-1H-pyridine-2-carbonyl)amino]acetate

Drug info:

PubChemData

Smile

COC1=C(C(=C(C=C1)[C@H]2[C@@H](N3C(C24C(=O)C5=CC=CC=C5C4=O)C=CC6=C3C=CC(=C6)F)C(=O)C7=CC=CC=C7)OC)OC

DOS

IR

Vibrations