Geometry & MOs

Info

ID:	37325
PubChem CID:	8019652
Reduced:	NF2O3C13H13 (1)
Stoich.:	AB2C3D13E13 (1)
Weight, g/mol:	302.022498
ΔH_f, kcal/mol:	-187.92
Dipole, Da:	4.3
IP(EA), eV:	-9.26(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(3,5-dichloropyridin-2-yl)amino]-2-oxoethyl] (1R,2S)-2-methylcyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

C[C@@H]1C[C@H]1C(=O)OCC(=O)NC2=C(C=CC(=C2)F)F

DOS

IR

Vibrations