Geometry & MOs

Info

ID:	418235
PubChem CID:	135103925
Reduced:	FN2O3C24H29 (1)
Stoich.:	AB2C3D24E29 (1)
Weight, g/mol:	293.156184
ΔH_f, kcal/mol:	-134.7
Dipole, Da:	5.16
IP(EA), eV:	-8.93(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-(pyridin-2-ylmethyl)-2-(2-pyrrolidin-1-ylethylsulfanyl)acetamide

Drug info:

PubChemData

Smile

CN(CC1=CC=C(C=C1)F)CC(=O)N2CCC3(CC2)C4=C(CCO3)C=CC=C4OC

DOS

IR

Vibrations