Geometry & MOs

Info

ID:	48453
PubChem CID:	10584897
Reduced:	N2O3H10C11 (1)
Stoich.:	A2B3C10D11 (1)
Weight, g/mol:	218.091609
ΔH_f, kcal/mol:	-69.67
Dipole, Da:	4.93
IP(EA), eV:	-10.15(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-aminoanilino)-2H-triazole-4-carboxamide

Drug info:

PubChemData

Smile

C1C(=O)OC(=N1)CNC(=O)C2=CC=CC=C2

DOS

IR

Vibrations