Geometry & MOs

Info

ID:	336103
PubChem CID:	127255110
Reduced:	O2N5C16H17 (1)
Stoich.:	A2B5C16D17 (1)
Weight, g/mol:	368.116778
ΔH_f, kcal/mol:	23.56
Dipole, Da:	6.27
IP(EA), eV:	-9.19(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-dimethyl-2-(tetrazol-1-yl)-N-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]thiophene-3-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2=C(C=NN2)C(=O)NCCN3C=CC=N3

DOS

IR

Vibrations