Geometry & MOs

Info

ID:	279906
PubChem CID:	103845601
Reduced:	NOC17H29 (1)
Stoich.:	ABC17D29 (1)
Weight, g/mol:	249.209264
ΔH_f, kcal/mol:	-74.31
Dipole, Da:	3.06
IP(EA), eV:	-8.7(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-2-[[(4-ethylphenyl)methylamino]methyl]butan-1-ol

Drug info:

PubChemData

Smile

CCC(CC)(CNCC1=C(C=C(C(=C1)C)C)C)CO

DOS

IR

Vibrations