Geometry & MOs

Info

ID:	269534
PubChem CID:	103617897
Reduced:	ON5C8H15 (1)
Stoich.:	AB5C8D15 (1)
Weight, g/mol:	234.082684
ΔH_f, kcal/mol:	-15.14
Dipole, Da:	5.78
IP(EA), eV:	-9.96(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyano-2-methyl-N-(2-methylsulfanylphenyl)propanamide

Drug info:

PubChemData

Smile

CCNC(=O)NCC1=NN=CN1CC

DOS

IR

Vibrations