Geometry & MOs

Info

ID:	377874
PubChem CID:	134223939
Reduced:	NOC13H15 (1)
Stoich.:	ABC13D15 (1)
Weight, g/mol:	426.13036
ΔH_f, kcal/mol:	9.83
Dipole, Da:	4.18
IP(EA), eV:	-8.71(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-amino-3-[4-(trifluoromethyl)anilino]furo[2,3-c]pyridin-7-yl]-N-methylbenzamide

Drug info:

PubChemData

Smile

C/C=C\C1=C(NC(=O)C(=C1)C(C)C)C#C

DOS

IR

Vibrations