Geometry & MOs

Info

ID:	190057
PubChem CID:	77945857
Reduced:	N2O3H12C14 (1)
Stoich.:	A2B3C12D14 (1)
Weight, g/mol:	449.164537
ΔH_f, kcal/mol:	33.04
Dipole, Da:	4.25
IP(EA), eV:	-8.99(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[4-[5-(aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-N-(1,3-thiazol-2-ylmethyl)-1,2,5-triazepane-1-carboxamide

Drug info:

PubChemData

Smile

CC1OC(O1)C2=CNC3=C2C4C=CC=CC4=NC3=O

DOS

IR

Vibrations