Geometry & MOs

Info

ID:	233750
PubChem CID:	92093324
Reduced:	NO2H8C10 (2)
Stoich.:	AB2C8D10 (2)
Weight, g/mol:	349.106256
ΔH_f, kcal/mol:	-38.21
Dipole, Da:	4.38
IP(EA), eV:	-8.92(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[6-(furan-2-yl)pyridin-3-yl]methyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC2=C1OC(=C2)C(=O)NCC3=CN=C(C=C3)C4=CC=CO4

DOS

IR

Vibrations