Geometry & MOs

Info

ID:	412942
PubChem CID:	135085879
Reduced:	ClOC11H13 (1)
Stoich.:	ABC11D13 (1)
Weight, g/mol:	199.157229
ΔH_f, kcal/mol:	-34.53
Dipole, Da:	3.72
IP(EA), eV:	-9.24(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyl-6-oxooctan-4-yl)acetamide

Drug info:

PubChemData

Smile

CC(C)(C(=C)C1=CC(=CC=C1)Cl)O

DOS

IR

Vibrations