Geometry & MOs

Info

ID:	286261
PubChem CID:	104169965
Reduced:	ON3C12H23 (1)
Stoich.:	AB3C12D23 (1)
Weight, g/mol:	225.184112
ΔH_f, kcal/mol:	-31.63
Dipole, Da:	1.42
IP(EA), eV:	-8.79(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-methoxypropyl)pyrazol-3-yl]methyl]-2-methylpropan-1-amine

Drug info:

PubChemData

Smile

CC(CN1C=CC(=N1)CNC(C)(C)C)OC

DOS

IR

Vibrations