Geometry & MOs

Info

ID:	302617
PubChem CID:	124385310
Reduced:	OC6H10 (3)
Stoich.:	AB6C10 (3)
Weight, g/mol:	277.131408
ΔH_f, kcal/mol:	-141.19
Dipole, Da:	3.78
IP(EA), eV:	-9.41(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3S,4S)-6-acetyl-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]acetamide

Drug info:

PubChemData

Smile

CCC[C@@H](/C=C/C#CCCCCCCCCCC(=O)O)O

DOS

IR

Vibrations