Geometry & MOs

Info

ID:	270626
PubChem CID:	103637362
Reduced:	BrON2C13H21 (1)
Stoich.:	ABC2D13E21 (1)
Weight, g/mol:	271.157229
ΔH_f, kcal/mol:	-33.95
Dipole, Da:	5.64
IP(EA), eV:	-8.8(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(4-ethylphenyl)methylamino]methyl]-5-methoxyphenol

Drug info:

PubChemData

Smile

CN(C)CCCCNCC1=C(C=CC(=C1)Br)O

DOS

IR

Vibrations