Geometry & MOs

Info

ID:	324027
PubChem CID:	126676783
Reduced:	N7C20H21 (1)
Stoich.:	A7B20C21 (1)
Weight, g/mol:	377.157578
ΔH_f, kcal/mol:	137.36
Dipole, Da:	5.76
IP(EA), eV:	-8.97(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[1-benzyl-3-(trifluoromethyl)pyrazol-4-yl]methyl]-6-hydrazinylpyridine-2,5-diamine

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C=CC(=C2)CN3C=C(C=N3)CC4=CC(=NC5=NNN=C45)N

DOS

IR

Vibrations