Geometry & MOs

Info

ID:	427971
PubChem CID:	135165612
Reduced:	NOC10H17 (1)
Stoich.:	ABC10D17 (1)
Weight, g/mol:	142.09938
ΔH_f, kcal/mol:	-27.79
Dipole, Da:	2.95
IP(EA), eV:	-8.57(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-hydroxy-2-methyl-4-methylidenehexan-3-one

Drug info:

PubChemData

Smile

CC(C)C(=O)C(=C)CC(=C)NC

DOS

IR

Vibrations