Geometry & MOs

Info

ID:	24266
PubChem CID:	608885
Reduced:	O2N4C11H14 (1)
Stoich.:	A2B4C11D14 (1)
Weight, g/mol:	234.111676
ΔH_f, kcal/mol:	4.23
Dipole, Da:	6.69
IP(EA), eV:	-8.11(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-dimethoxyphenyl)-4-methyl-1,2,4-triazol-3-amine

Drug info:

PubChemData

Smile

CN1C=NN=C1NC2=C(C=CC(=C2)OC)OC

DOS

IR

Vibrations