Geometry & MOs

Info

ID:	342979
PubChem CID:	127266142
Reduced:	O2F3N4C12H13 (1)
Stoich.:	A2B3C4D12E13 (1)
Weight, g/mol:	327.094309
ΔH_f, kcal/mol:	-171.49
Dipole, Da:	4.76
IP(EA), eV:	-9.72(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyltetrazol-5-yl)-[6-(trifluoromethoxy)-3,4-dihydro-2H-quinolin-1-yl]methanone

Drug info:

PubChemData

Smile

CCN(CC(C(F)(F)F)O)C(=O)C1=NN2C=CC=NC2=C1

DOS

IR

Vibrations