Geometry & MOs

Info

ID:	209767
PubChem CID:	80718884
Reduced:	FON5H8C11 (1)
Stoich.:	ABC5D8E11 (1)
Weight, g/mol:	264.183778
ΔH_f, kcal/mol:	60.14
Dipole, Da:	5.13
IP(EA), eV:	-10.1(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyano-N-(7-oxabicyclo[2.2.1]heptan-2-yl)-2-propylpentanamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C2=NC(=NO2)C3=NC=NN3)F

DOS

IR

Vibrations