Geometry & MOs

Info

ID:	378419
PubChem CID:	134224500
Reduced:	FN4O6C41H47 (1)
Stoich.:	AB4C6D41E47 (1)
Weight, g/mol:	271.120843
ΔH_f, kcal/mol:	-266.79
Dipole, Da:	11.94
IP(EA), eV:	-8.71(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2-oxo-4-propan-2-ylpyridine-1-carboxylate

Drug info:

PubChemData

Smile

CCN(CC)C1=C(C=C2C(=C1)OC(=C2C(=O)NC)C3=CC=C(C=C3)F)C4=CC(=CC=C4)C(=O)N[C@@H]5CCCC[C@H]5C(=O)N[C@@H]6CCCC[C@H]6C(=O)O

DOS

IR

Vibrations