Geometry & MOs

Info

ID:	207855
PubChem CID:	80461763
Reduced:	N2O3C9H12 (1)
Stoich.:	A2B3C9D12 (1)
Weight, g/mol:	180.126263
ΔH_f, kcal/mol:	-66.15
Dipole, Da:	5.17
IP(EA), eV:	-9.38(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-ethyl-4-methyl-1,2-oxazol-3-yl)methyl]cyclopropanamine

Drug info:

PubChemData

Smile

CCN1CCC2=C(C1)C(=NO2)C(=O)O

DOS

IR

Vibrations