Geometry & MOs

Info

ID:	307126
PubChem CID:	125269224
Reduced:	O2F3N6H15C19 (1)
Stoich.:	A2B3C6D15E19 (1)
Weight, g/mol:	217.048741
ΔH_f, kcal/mol:	-69.53
Dipole, Da:	1.52
IP(EA), eV:	-9.08(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-nitro-6-pyridin-4-yl-3H-pyridin-2-one

Drug info:

PubChemData

Smile

C1C(=C2C=CC=CC2=N1)CCNC(=O)C3=NN(N=N3)C4=CC=C(C=C4)OC(F)(F)F

DOS

IR

Vibrations