Geometry & MOs

Info

ID:	263354
PubChem CID:	103358765
Reduced:	SO2N4C13H18 (1)
Stoich.:	AB2C4D13E18 (1)
Weight, g/mol:	193.121512
ΔH_f, kcal/mol:	-50.31
Dipole, Da:	2.23
IP(EA), eV:	-8.14(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-aminopyridin-4-yl)-3-methylpyrrolidin-3-ol

Drug info:

PubChemData

Smile

CC1=NN(C2=C1C(=C(S2)C(=O)N3CCC(C3)(C)O)N)C

DOS

IR

Vibrations