Geometry & MOs

Info

ID:	291511
PubChem CID:	113000016
Reduced:	ClFN2O4H16C18 (1)
Stoich.:	ABC2D4E16F18 (1)
Weight, g/mol:	376.153541
ΔH_f, kcal/mol:	-183.65
Dipole, Da:	2.98
IP(EA), eV:	-9.21(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-(3-acetamidoanilino)pyridin-3-yl]-3-methoxybenzamide

Drug info:

PubChemData

Smile

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CNC(=O)CC2=CC=C(C=C2)F

DOS

IR

Vibrations