Geometry & MOs

Info

ID:	272244
PubChem CID:	103736622
Reduced:	ClSN2C11H15 (1)
Stoich.:	ABC2D11E15 (1)
Weight, g/mol:	248.09094
ΔH_f, kcal/mol:	8.15
Dipole, Da:	3.43
IP(EA), eV:	-8.78(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-3-nitropyridin-2-amine

Drug info:

PubChemData

Smile

CSC1CCCC1NC2=C(C=NC=C2)Cl

DOS

IR

Vibrations