Geometry & MOs

Info

ID:	54640
PubChem CID:	17389024
Reduced:	N2O5H10C15 (1)
Stoich.:	A2B5C10D15 (1)
Weight, g/mol:	237.030504
ΔH_f, kcal/mol:	-52.42
Dipole, Da:	9.25
IP(EA), eV:	-9.53(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-chloropyrimidin-4-yl)-2-methylfuran-3-carboxamide

Drug info:

PubChemData

Smile

CC(=O)OC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-]

DOS

IR

Vibrations