Geometry & MOs

Info

ID:	211825
PubChem CID:	81054337
Reduced:	SN3C16H25 (1)
Stoich.:	AB3C16D25 (1)
Weight, g/mol:	249.129969
ΔH_f, kcal/mol:	2.74
Dipole, Da:	6.6
IP(EA), eV:	-8.47(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[cyclopropylmethyl(methyl)amino]-2,6-dimethylpyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=S)N)N(C)C2CCCCCC2

DOS

IR

Vibrations