Geometry & MOs

Info

ID:	282899
PubChem CID:	103944651
Reduced:	NO2C18H21 (1)
Stoich.:	AB2C18D21 (1)
Weight, g/mol:	231.183444
ΔH_f, kcal/mol:	-71.84
Dipole, Da:	3.57
IP(EA), eV:	-9.31(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxy-2,2-dimethylbutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)C(=O)N[C@@H](CO)C2=CC=CC=C2)C

DOS

IR

Vibrations