Geometry & MOs

Info

ID:	276809
PubChem CID:	103825362
Reduced:	ClNO2C15H20 (1)
Stoich.:	ABC2D15E20 (1)
Weight, g/mol:	307.1606
ΔH_f, kcal/mol:	-84.86
Dipole, Da:	3.12
IP(EA), eV:	-9.56(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-N-(4-hydroxy-2,2-dimethylbutyl)acetamide

Drug info:

PubChemData

Smile

CC(C)(CCO)CNC(=O)/C=C/C1=CC=CC=C1Cl

DOS

IR

Vibrations