Geometry & MOs

Info

ID:	70186
PubChem CID:	47211577
Reduced:	SO2N4C11H18 (1)
Stoich.:	AB2C4D11E18 (1)
Weight, g/mol:	273.122575
ΔH_f, kcal/mol:	-46.01
Dipole, Da:	3.82
IP(EA), eV:	-9.11(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-oxopyridin-1-yl)-N-[2-(pyrimidin-2-ylamino)ethyl]acetamide

Drug info:

PubChemData

Smile

COCCSCC(=O)NCCNC1=NC=CC=N1

DOS

IR

Vibrations