Geometry & MOs

Info

ID:	34080
PubChem CID:	7889737
Reduced:	N2O3F6H10C16 (1)
Stoich.:	A2B3C6D10E16 (1)
Weight, g/mol:	380.140593
ΔH_f, kcal/mol:	-384.61
Dipole, Da:	5.42
IP(EA), eV:	-9.88(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[cyclohexyl-[(3S)-1,1-dioxothiolan-3-yl]amino]-2-oxoethyl] pyridine-4-carboxylate

Drug info:

PubChemData

Smile

C1=CN=CC=C1C(=O)OCC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations