Geometry & MOs

Info

ID:	319204
PubChem CID:	126655299
Reduced:	FO4N6H23C24 (1)
Stoich.:	AB4C6D23E24 (1)
Weight, g/mol:	196.132411
ΔH_f, kcal/mol:	-95.51
Dipole, Da:	2.2
IP(EA), eV:	-8.86(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-morpholin-4-ylethyl)-1H-pyrazol-5-amine

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC2=C(C1=O)C(=CC(=N2)C3=C(C=CC=C3F)C#N)N4C=CC(=N4)NCCO

DOS

IR

Vibrations