Geometry & MOs

Info

ID:	324345
PubChem CID:	126677477
Reduced:	SC15H24 (1)
Stoich.:	AB15C24 (1)
Weight, g/mol:	420.131029
ΔH_f, kcal/mol:	20.52
Dipole, Da:	1.62
IP(EA), eV:	-8.38(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(6-methylpyridin-2-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]-6-(trifluoromethyl)quinolin-4-amine

Drug info:

PubChemData

Smile

CCCCS/C=C/C(=C)CCC(=C)/C=C/C

DOS

IR

Vibrations