Geometry & MOs

Info

ID:	246739
PubChem CID:	103064760
Reduced:	OSN2C14H20 (1)
Stoich.:	ABC2D14E20 (1)
Weight, g/mol:	279.140533
ΔH_f, kcal/mol:	-41.83
Dipole, Da:	6.83
IP(EA), eV:	-8.46(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-6-tert-butyl-N-(thiolan-3-yl)pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCNC1=C(C=C(C=C1)C(=O)NC2CCSC2)C

DOS

IR

Vibrations