Geometry & MOs

Info

ID:	208833
PubChem CID:	80591846
Reduced:	OSN2C12H14 (1)
Stoich.:	ABC2D12E14 (1)
Weight, g/mol:	215.105862
ΔH_f, kcal/mol:	29.98
Dipole, Da:	4.67
IP(EA), eV:	-9.36(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyano-N-(2,6-dimethylpyridin-3-yl)cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CN(CCC1=CC=CS1)C(=O)C2(CC2)C#N

DOS

IR

Vibrations