Geometry & MOs

Info

ID:	257380
PubChem CID:	103145637
Reduced:	N2O5C14H16 (1)
Stoich.:	A2B5C14D16 (1)
Weight, g/mol:	287.090606
ΔH_f, kcal/mol:	-125.33
Dipole, Da:	8.91
IP(EA), eV:	-9.51(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-dimethyl-4-nitrophenyl)-5-hydroxypyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1[N+](=O)[O-])C)NC(=O)C2(CCC2)C(=O)O

DOS

IR

Vibrations