Geometry & MOs

Info

ID:	290044
PubChem CID:	104402383
Reduced:	N3O3C15H19 (1)
Stoich.:	A3B3C15D19 (1)
Weight, g/mol:	293.119798
ΔH_f, kcal/mol:	-97.3
Dipole, Da:	6.54
IP(EA), eV:	-9.05(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-aminoprop-1-ynyl)-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]thiophene-3-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NCCOC)NC(=O)C1=CC2=C(C=C1)NC=C2

DOS

IR

Vibrations