Geometry & MOs

Info

ID:	401807
PubChem CID:	135052689
Reduced:	SN3C11H13 (1)
Stoich.:	AB3C11D13 (1)
Weight, g/mol:	159.089543
ΔH_f, kcal/mol:	74.39
Dipole, Da:	3.88
IP(EA), eV:	-8.8(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetyl-N-hydroxy-3-methylbutanamide

Drug info:

PubChemData

Smile

CN(C)C1=NN=CC(S1)C2=CC=CC=C2

DOS

IR

Vibrations