Geometry & MOs

Info

ID:	185625
PubChem CID:	77321973
Reduced:	SN2O4C21H30 (1)
Stoich.:	AB2C4D21E30 (1)
Weight, g/mol:	237.172879
ΔH_f, kcal/mol:	-155.1
Dipole, Da:	4.18
IP(EA), eV:	-8.7(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-3-(2,4,4-trimethylpentyl)-1H-pyridine-2,4-dione

Drug info:

PubChemData

Smile

CCCCC(C(=O)C(=O)N)NC(=O)C1(CCCCC1)CS(=O)C2=CC=CC=C2

DOS

IR

Vibrations