Geometry & MOs

Info

ID:	279344
PubChem CID:	103843205
Reduced:	N2O3C16H22 (1)
Stoich.:	A2B3C16D22 (1)
Weight, g/mol:	313.155705
ΔH_f, kcal/mol:	-132.23
Dipole, Da:	5.41
IP(EA), eV:	-9.32(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-chloropyridin-2-yl)-methylamino]-N-[2-ethyl-2-(hydroxymethyl)butyl]acetamide

Drug info:

PubChemData

Smile

CCC(CC)(CNC(=O)C1=CC2=C(C=C1)NC(=O)C2)CO

DOS

IR

Vibrations