Geometry & MOs

Info

ID:	372142
PubChem CID:	131293738
Reduced:	ION2C8H9 (1)
Stoich.:	ABC2D8E9 (1)
Weight, g/mol:	191.040485
ΔH_f, kcal/mol:	-11.59
Dipole, Da:	4.37
IP(EA), eV:	-8.8(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(cyclobutanecarbonyl)thiophene-2-carbonitrile

Drug info:

PubChemData

Smile

CC(=O)C1=C(C=C(C=C1I)N)N

DOS

IR

Vibrations