Geometry & MOs

Info

ID:	328074
PubChem CID:	126691964
Reduced:	N3O5F6H31C33 (1)
Stoich.:	A3B5C6D31E33 (1)
Weight, g/mol:	214.035397
ΔH_f, kcal/mol:	-428.31
Dipole, Da:	7.37
IP(EA), eV:	-8.58(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(trifluoromethoxy)-1,5-naphthyridine

Drug info:

PubChemData

Smile

CC1C(OC(=O)N1CC2=C(C=CC(=N2)N3CCC3)C4=C(C=CC(=C4)CCC(=O)O)OC5CC5)C6=CC(=CC(=C6)C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations