Geometry & MOs

Info

ID:	197382
PubChem CID:	78960189
Reduced:	BrNOC16H18 (1)
Stoich.:	ABCD16E18 (1)
Weight, g/mol:	276.09102
ΔH_f, kcal/mol:	-5.07
Dipole, Da:	3.11
IP(EA), eV:	-8.94(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-oxopyridin-1-yl)ethyl 2-amino-5-fluorobenzoate

Drug info:

PubChemData

Smile

C[C@H](C1=C(C=CC(=C1)Br)OC(C)C2=CC=CC=C2)N

DOS

IR

Vibrations