Geometry & MOs

Info

ID:	342083
PubChem CID:	127264796
Reduced:	FN3C15H18 (1)
Stoich.:	AB3C15D18 (1)
Weight, g/mol:	332.184841
ΔH_f, kcal/mol:	25.83
Dipole, Da:	5.33
IP(EA), eV:	-9.1(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[1H-indazol-6-ylmethyl(2-morpholin-4-ylethyl)amino]acetate

Drug info:

PubChemData

Smile

C1CN(CCN1CC=CC2=CC=C(C=C2)F)CC#N

DOS

IR

Vibrations