Geometry & MOs

Info

ID:	325089
PubChem CID:	126680568
Reduced:	ON5C16H21 (1)
Stoich.:	AB5C16D21 (1)
Weight, g/mol:	326.149124
ΔH_f, kcal/mol:	13.6
Dipole, Da:	5.32
IP(EA), eV:	-8.53(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclopropyloxy-2-[(3,6-diamino-2-hydrazinylpyridin-4-yl)oxymethyl]benzonitrile

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2CC1COC3=CC(=NC(=C3N)NN)N

DOS

IR

Vibrations