Geometry & MOs

Info

ID:	281394
PubChem CID:	103913808
Reduced:	NO2C8H13 (2)
Stoich.:	AB2C8D13 (2)
Weight, g/mol:	267.183444
ΔH_f, kcal/mol:	-185.25
Dipole, Da:	5.42
IP(EA), eV:	-8.2(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[(2-hydroxy-4-methylpentyl)amino]ethyl]-4-methoxyphenol

Drug info:

PubChemData

Smile

CC(C1=C(C=CC(=C1)OC)O)NCCNC(=O)OC(C)(C)C

DOS

IR

Vibrations