Geometry & MOs

Info

ID:	56739
PubChem CID:	22389262
Reduced:	F3O3N4C17H17 (1)
Stoich.:	A3B3C4D17E17 (1)
Weight, g/mol:	339.119461
ΔH_f, kcal/mol:	-211.76
Dipole, Da:	1.95
IP(EA), eV:	-8.98(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-azabicyclo[3.2.1]octan-3-yl)-3-(trifluoromethyl)furo[3,2-c]pyridine-6-carboxamide

Drug info:

PubChemData

Smile

C1CN2CC1CC(C2)NC(=O)C3=NC=C4C(=C3)C=C(O4)NC(=O)C(F)(F)F

DOS

IR

Vibrations