Geometry & MOs

Info

ID:	285252
PubChem CID:	104098813
Reduced:	N4C11H20 (1)
Stoich.:	A4B11C20 (1)
Weight, g/mol:	251.084081
ΔH_f, kcal/mol:	32.67
Dipole, Da:	4.83
IP(EA), eV:	-9.42(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[2-(triazol-1-yl)ethylamino]methyl]thiophene-3-carboxamide

Drug info:

PubChemData

Smile

CCC1CCC(C1)NCCN2C=CN=N2

DOS

IR

Vibrations