Geometry & MOs

Info

ID:	212635
PubChem CID:	81061277
Reduced:	SN4C16H26 (1)
Stoich.:	AB4C16D26 (1)
Weight, g/mol:	302.120132
ΔH_f, kcal/mol:	13.01
Dipole, Da:	5.69
IP(EA), eV:	-8.54(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(6-methoxypyridin-3-yl)methylamino]-2,6-dimethylpyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CCC(C)N1CCN(CC1)C2=C(C(=NC(=C2)C)C)C(=S)N

DOS

IR

Vibrations