Geometry & MOs

Info

ID:	403395
PubChem CID:	135060041
Reduced:	O3C14H28 (1)
Stoich.:	A3B14C28 (1)
Weight, g/mol:	219.162314
ΔH_f, kcal/mol:	-125.71
Dipole, Da:	2.95
IP(EA), eV:	-8.97(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(N,4-dimethylanilino)hexan-3-one

Drug info:

PubChemData

Smile

CCCCC(=O)C[C@@H](CCC)OOC(C)(C)C

DOS

IR

Vibrations