Geometry & MOs

Info

ID:	323561
PubChem CID:	126675474
Reduced:	N7C19H19 (1)
Stoich.:	A7B19C19 (1)
Weight, g/mol:	458.229106
ΔH_f, kcal/mol:	132.28
Dipole, Da:	5.37
IP(EA), eV:	-8.33(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[4-[(3,6-diamino-2-hydrazinylpyridin-4-yl)methyl]pyrazol-1-yl]methyl]-N-[(5-methylpyrazin-2-yl)methyl]benzamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC=C2N3C=C(C=N3)CC4=CC(=NC(=C4N)NN)N

DOS

IR

Vibrations