Geometry & MOs

Info

ID:	183153
PubChem CID:	76983846
Reduced:	O2N5C12H13 (1)
Stoich.:	A2B5C12D13 (1)
Weight, g/mol:	181.09636
ΔH_f, kcal/mol:	20.58
Dipole, Da:	5.86
IP(EA), eV:	-8.89(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-[5-(1H-pyrazol-4-yl)-2,3-dihydro-1,2,4-oxadiazol-3-yl]methanamine

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CC(=NO)N)NC(=O)C2=CNN=C2

DOS

IR

Vibrations