Geometry & MOs

Info

ID:	260018
PubChem CID:	103179177
Reduced:	FINO2C12H17 (1)
Stoich.:	ABCD2E12F17 (1)
Weight, g/mol:	213.147727
ΔH_f, kcal/mol:	-95.75
Dipole, Da:	4.23
IP(EA), eV:	-8.23(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-methoxypropoxy)ethyl]-1-methylpyrazol-4-amine

Drug info:

PubChemData

Smile

COCCCOCCNC1=C(C=C(C=C1)F)I

DOS

IR

Vibrations