Geometry & MOs

Info

ID:	272122
PubChem CID:	103724863
Reduced:	ClON3C10H14 (1)
Stoich.:	ABC3D10E14 (1)
Weight, g/mol:	244.178693
ΔH_f, kcal/mol:	-27.03
Dipole, Da:	4.06
IP(EA), eV:	-8.86(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[acetyl(methyl)amino]-N-[2-(2-hydroxyethyl)pentyl]acetamide

Drug info:

PubChemData

Smile

C1CC(C(C1)NC2=NC=C(C=N2)Cl)CO

DOS

IR

Vibrations