Geometry & MOs

Info

ID:	343912
PubChem CID:	127267088
Reduced:	O2N4C15H16 (1)
Stoich.:	A2B4C15D16 (1)
Weight, g/mol:	254.108899
ΔH_f, kcal/mol:	-3.16
Dipole, Da:	5.09
IP(EA), eV:	-8.86(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-2-[(2-oxo-1H-pyridin-4-yl)methylsulfanyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)CN2C=NC3=C(C2=O)C=NN3C)OC

DOS

IR

Vibrations