Geometry & MOs

Info

ID:	37483
PubChem CID:	8021511
Reduced:	FCl2N2O3H11C15 (1)
Stoich.:	AB2C2D3E11F15 (1)
Weight, g/mol:	378.053798
ΔH_f, kcal/mol:	-131.17
Dipole, Da:	2.6
IP(EA), eV:	-8.99(-1.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-[[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl] 5,6-dichloropyridine-3-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=CC(=C(N=C2)Cl)Cl)F

DOS

IR

Vibrations