Geometry & MOs

Info

ID:	388040
PubChem CID:	134987934
Reduced:	INO2C15H18 (1)
Stoich.:	ABC2D15E18 (1)
Weight, g/mol:	171.125929
ΔH_f, kcal/mol:	-21.13
Dipole, Da:	5.62
IP(EA), eV:	-9.76(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-oxoheptan-2-yl)acetamide

Drug info:

PubChemData

Smile

C=CCN(CC1=CC=CC=C1)C(=O)C(C(C=C)O)I

DOS

IR

Vibrations