Geometry & MOs

Info

ID:	136708
PubChem CID:	52087565
Reduced:	N2O4C23H28 (1)
Stoich.:	A2B4C23D28 (1)
Weight, g/mol:	461.140927
ΔH_f, kcal/mol:	-135.53
Dipole, Da:	3.68
IP(EA), eV:	-8.75(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(furan-2-ylmethyl)-2-[3-(5-phenyl-1,3-oxazol-2-yl)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide

Drug info:

PubChemData

Smile

CCCOC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)O[C@@H](C(=O)N3CC(C)C)C

DOS

IR

Vibrations