Geometry & MOs

Info

ID:	28714
PubChem CID:	829112
Reduced:	NF6H9C10 (1)
Stoich.:	AB6C9D10 (1)
Weight, g/mol:	333.093583
ΔH_f, kcal/mol:	-315.57
Dipole, Da:	5.28
IP(EA), eV:	-9.16(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-methyl-12-quinolin-8-yloxy-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraene

Drug info:

PubChemData

Smile

CC1=C(C(=C(C=C1C(F)(F)F)C(F)(F)F)C)N

DOS

IR

Vibrations