Geometry & MOs

Info

ID:	144750
PubChem CID:	53407494
Reduced:	ClON2C9H11 (1)
Stoich.:	ABC2D9E11 (1)
Weight, g/mol:	255.041069
ΔH_f, kcal/mol:	-12.06
Dipole, Da:	3.01
IP(EA), eV:	-9.54(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-(4-nitrophenyl)-1,3-oxazol-4-amine;hydrochloride

Drug info:

PubChemData

Smile

C1=CC2C(C=C1)N(C(=O)N2)CCCl

DOS

IR

Vibrations