Geometry & MOs

Info

ID:	287669
PubChem CID:	104251307
Reduced:	FNO2C15H24 (1)
Stoich.:	ABC2D15E24 (1)
Weight, g/mol:	225.184112
ΔH_f, kcal/mol:	-127.33
Dipole, Da:	4.87
IP(EA), eV:	-8.84(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-1-(2-methylpyrazol-3-yl)-N-propylbutan-1-amine

Drug info:

PubChemData

Smile

CCCNC(CC(C)OC)C1=CC(=C(C=C1)OC)F

DOS

IR

Vibrations