Geometry & MOs

Info

ID:	280932
PubChem CID:	103851999
Reduced:	ON3C13H23 (1)
Stoich.:	AB3C13D23 (1)
Weight, g/mol:	237.184112
ΔH_f, kcal/mol:	-24.34
Dipole, Da:	4.37
IP(EA), eV:	-8.85(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,5-dimethylpyrazol-4-yl)methyl]-1-(oxan-4-yl)ethanamine

Drug info:

PubChemData

Smile

CC1=NN(C=C1CNC(C)C2CCOCC2)C

DOS

IR

Vibrations