Geometry & MOs

Info

ID:	251381
PubChem CID:	103103559
Reduced:	N4O4C11H14 (1)
Stoich.:	A4B4C11D14 (1)
Weight, g/mol:	283.096834
ΔH_f, kcal/mol:	-144.63
Dipole, Da:	13.06
IP(EA), eV:	-9.47(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(2-amino-2-oxoethyl)-ethylcarbamoyl]amino]-6-fluorobenzoic acid

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C(=O)NC1=CN=C(C=C1)C(=O)O

DOS

IR

Vibrations