Geometry & MOs

Info

ID:	207866
PubChem CID:	80462864
Reduced:	N2O3C14H16 (1)
Stoich.:	A2B3C14D16 (1)
Weight, g/mol:	194.141913
ΔH_f, kcal/mol:	-30.35
Dipole, Da:	5.61
IP(EA), eV:	-8.85(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-cyclopropyl-4-methyl-1,2-oxazol-3-yl)methyl]propan-1-amine

Drug info:

PubChemData

Smile

CNCC1=NOC(=C1)C2=CC3=C(C=C2)OCCCO3

DOS

IR

Vibrations