Geometry & MOs

Info

ID:	296511
PubChem CID:	117580866
Reduced:	NO3C14H23 (1)
Stoich.:	AB3C14D23 (1)
Weight, g/mol:	251.188529
ΔH_f, kcal/mol:	-125.38
Dipole, Da:	3.5
IP(EA), eV:	-8.58(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2,3,4-trimethylphenyl)ethylamino]butane-1,4-diol

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)CN(C)C(CCO)CO)OC

DOS

IR

Vibrations