Geometry & MOs

Info

ID:	269062
PubChem CID:	103609543
Reduced:	SO2C14H20 (1)
Stoich.:	AB2C14D20 (1)
Weight, g/mol:	194.105528
ΔH_f, kcal/mol:	-88.64
Dipole, Da:	3.86
IP(EA), eV:	-8.77(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(propan-2-ylamino)pyridine-4-carboxylate

Drug info:

PubChemData

Smile

CC(C)CCSCC1=CC=C(C=C1)C(=O)OC

DOS

IR

Vibrations