Geometry & MOs

Info

ID:	375487
PubChem CID:	131529972
Reduced:	ON2C12H16 (1)
Stoich.:	AB2C12D16 (1)
Weight, g/mol:	230.062618
ΔH_f, kcal/mol:	-6.69
Dipole, Da:	4.34
IP(EA), eV:	-8.89(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-4-[(4-methyl-1,3-thiazol-2-yl)amino]pyridine-2-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC2=C(O1)CCNC2CCCC#N

DOS

IR

Vibrations