Geometry & MOs

Info

ID:	259506
PubChem CID:	103167089
Reduced:	N3C16H17 (1)
Stoich.:	A3B16C17 (1)
Weight, g/mol:	180.126263
ΔH_f, kcal/mol:	92.23
Dipole, Da:	7.95
IP(EA), eV:	-9.27(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(cyclobutylmethyl)-1,3-oxazol-2-yl]ethanamine

Drug info:

PubChemData

Smile

C1CC(C1)CC2=NC3=C(N2C4CC4)C=CC(=C3)C#N

DOS

IR

Vibrations