Geometry & MOs

Info

ID:	273322
PubChem CID:	103770910
Reduced:	SN2O4C14H28 (1)
Stoich.:	AB2C4D14E28 (1)
Weight, g/mol:	293.199094
ΔH_f, kcal/mol:	-216.85
Dipole, Da:	5.8
IP(EA), eV:	-9.74(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,4-dimethylphenoxy)-N-(2-hydroxy-4-methylpentyl)propanamide

Drug info:

PubChemData

Smile

CCCS(=O)(=O)N1CCCC1C(=O)NCC(CC(C)C)O

DOS

IR

Vibrations