Geometry & MOs

Info

ID:	24656
PubChem CID:	611896
Reduced:	ClNO3H8C12 (1)
Stoich.:	ABC3D8E12 (1)
Weight, g/mol:	249.019271
ΔH_f, kcal/mol:	-76.55
Dipole, Da:	2.76
IP(EA), eV:	-9.28(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chlorophenyl)-6-oxopyran-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)NC(=O)C2=COC(=O)C=C2)Cl

DOS

IR

Vibrations