Geometry & MOs

Info

ID:	138260
PubChem CID:	52335943
Reduced:	N3O3C22H23 (1)
Stoich.:	A3B3C22D23 (1)
Weight, g/mol:	350.13789
ΔH_f, kcal/mol:	-18.93
Dipole, Da:	4.48
IP(EA), eV:	-9.05(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-cyanophenoxy)methyl]-N-(2-propan-2-ylpyrazol-3-yl)furan-2-carboxamide

Drug info:

PubChemData

Smile

C[C@H](C1=CC2=CC=CC=C2C=C1)NC(=O)CO/N=C(/COC3=CC=CC=C3)\N

DOS

IR

Vibrations