Geometry & MOs

Info

ID:	271223
PubChem CID:	103648532
Reduced:	NO3C15H17 (1)
Stoich.:	AB3C15D17 (1)
Weight, g/mol:	273.136493
ΔH_f, kcal/mol:	-94.23
Dipole, Da:	3.65
IP(EA), eV:	-8.78(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[[3-(hydroxymethyl)phenyl]methylamino]methyl]-6-methoxyphenol

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)CO)CNCC2=C(C=C(C=C2)O)O

DOS

IR

Vibrations