Geometry & MOs

Info

ID:	76870
PubChem CID:	48425503
Reduced:	SN2O2C20H24 (1)
Stoich.:	AB2C2D20E24 (1)
Weight, g/mol:	295.135448
ΔH_f, kcal/mol:	-52.16
Dipole, Da:	3.51
IP(EA), eV:	-8.83(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-2-[[2-(pyridin-2-ylmethylsulfanyl)acetyl]amino]acetamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1=CC=C(C=C1)SCC2=CC=CC=C2

DOS

IR

Vibrations