Geometry & MOs

Info

ID:	246655
PubChem CID:	103064451
Reduced:	FNSO2C14H14 (1)
Stoich.:	ABCD2E14F14 (1)
Weight, g/mol:	266.054755
ΔH_f, kcal/mol:	-75.63
Dipole, Da:	4.36
IP(EA), eV:	-8.79(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-aminoprop-1-ynyl)-N-(thiolan-3-yl)thiophene-3-carboxamide

Drug info:

PubChemData

Smile

C1CSCC1NC(=O)C2=CC(=C(C=C2)C#CCO)F

DOS

IR

Vibrations