Geometry & MOs

Info

ID:	296411
PubChem CID:	117572723
Reduced:	NOC5H10 (2)
Stoich.:	ABC5D10 (2)
Weight, g/mol:	265.167794
ΔH_f, kcal/mol:	-75.68
Dipole, Da:	3.54
IP(EA), eV:	-8.66(1.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-2-[(4-propan-2-yloxyanilino)methyl]butanoic acid

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC2(COC2)CO

DOS

IR

Vibrations