Geometry & MOs

Info

ID:	430412
PubChem CID:	135170476
Reduced:	ClON2C6H7 (1)
Stoich.:	ABC2D6E7 (1)
Weight, g/mol:	194.141913
ΔH_f, kcal/mol:	26.98
Dipole, Da:	2.74
IP(EA), eV:	-10.58(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-methyl-5-(2-methylbutan-2-yl)-1,2-oxazol-4-yl]methyl]methanimine

Drug info:

PubChemData

Smile

CC1=NOC(=N1)C2(CC2)Cl

DOS

IR

Vibrations