Geometry & MOs

Info

ID:	183976
PubChem CID:	77098435
Reduced:	O2N4C19H28 (1)
Stoich.:	A2B4C19D28 (1)
Weight, g/mol:	261.122575
ΔH_f, kcal/mol:	-32.01
Dipole, Da:	5.2
IP(EA), eV:	-8.58(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-ethyl-1,2,4-triazol-3-yl)methoxy]-N'-hydroxybenzenecarboximidamide

Drug info:

PubChemData

Smile

CN1CCN(CC1CO)CC2=CC=C(C=C2)OCCCN3C=CN=C3

DOS

IR

Vibrations