Geometry & MOs

Info

ID:	279672
PubChem CID:	103844625
Reduced:	N2O3C13H20 (1)
Stoich.:	A2B3C13D20 (1)
Weight, g/mol:	265.167794
ΔH_f, kcal/mol:	-126.17
Dipole, Da:	5.9
IP(EA), eV:	-9.5(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-ethyl-2-(hydroxymethyl)butyl]-2-(3-hydroxyphenyl)acetamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations