Geometry & MOs

Info

ID:	279907
PubChem CID:	103845604
Reduced:	NOC16H27 (1)
Stoich.:	ABC16D27 (1)
Weight, g/mol:	295.214744
ΔH_f, kcal/mol:	-60.62
Dipole, Da:	3.12
IP(EA), eV:	-9.06(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(3-ethoxy-4-methoxyphenyl)methylamino]methyl]-2-ethylbutan-1-ol

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)CNCC(CC)(CC)CO

DOS

IR

Vibrations