Geometry & MOs

Info

ID:	157533
PubChem CID:	56435568
Reduced:	N4O4C23H26 (1)
Stoich.:	A4B4C23D26 (1)
Weight, g/mol:	433.106474
ΔH_f, kcal/mol:	-144.58
Dipole, Da:	3.29
IP(EA), eV:	-9.33(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-2-thiophen-2-yl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC(=O)NC(C1=CC=CC=C1)C(=O)NC2=CC=CC(=C2)C3(C(=O)NC(=O)N3)C

DOS

IR

Vibrations