Geometry & MOs

Info

ID:	220780
PubChem CID:	85239633
Reduced:	NO4C13H17 (1)
Stoich.:	AB4C13D17 (1)
Weight, g/mol:	252.20893
ΔH_f, kcal/mol:	-157.95
Dipole, Da:	2.58
IP(EA), eV:	-10.48(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

16-methyl-1-oxacyclohexadec-13-en-2-one

Drug info:

PubChemData

Smile

CCOC(=O)C1(CCCC(=O)C1CC(=O)C)C#N

DOS

IR

Vibrations