Geometry & MOs

Info

ID:	222739
PubChem CID:	85332225
Reduced:	O2N7C28H37 (1)
Stoich.:	A2B7C28D37 (1)
Weight, g/mol:	506.167808
ΔH_f, kcal/mol:	5.36
Dipole, Da:	4.18
IP(EA), eV:	-8.25(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-2-(4-fluorophenoxy)-N-[[2-fluoro-4-[3-(tetrazolidin-5-yl)phenyl]phenyl]methyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CN(C1CCCCC1)NC(=O)NC2=CC=CC3=C2C(=O)C4C3NNC4C5=CC=C(C=C5)N6CCNCC6

DOS

IR

Vibrations