Geometry & MOs

Info

ID:	210792
PubChem CID:	80856860
Reduced:	ON2C7H9 (2)
Stoich.:	AB2C7D9 (2)
Weight, g/mol:	233.091275
ΔH_f, kcal/mol:	30.59
Dipole, Da:	9.11
IP(EA), eV:	-9.05(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-6-(3-methylpyrazol-1-yl)-5-nitropyridin-2-amine

Drug info:

PubChemData

Smile

CCCNC1=C(C(=CC=C1)N2C=CN=C2CC)[N+](=O)[O-]

DOS

IR

Vibrations