Geometry & MOs

Info

ID:	183481
PubChem CID:	77028436
Reduced:	ON7C11H15 (1)
Stoich.:	AB7C11D15 (1)
Weight, g/mol:	212.138559
ΔH_f, kcal/mol:	122.28
Dipole, Da:	5.59
IP(EA), eV:	-8.66(-1.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-hydroxy-2-[(4-methyl-1,2,4-triazol-3-yl)methylamino]butanimidamide

Drug info:

PubChemData

Smile

CN1C=NN=C1CNCC2C=CC=NC2=C(N)N=O

DOS

IR

Vibrations