Geometry & MOs

Info

ID:	279752
PubChem CID:	103845004
Reduced:	ON2C8H15 (2)
Stoich.:	AB2C8D15 (2)
Weight, g/mol:	295.053069
ΔH_f, kcal/mol:	-91.76
Dipole, Da:	4.53
IP(EA), eV:	-9.22(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-[(2,5-dichlorophenyl)methylamino]ethyl]phenol

Drug info:

PubChemData

Smile

CCN1C(=CC=N1)CNCCCN(CC)C(=O)OC(C)(C)C

DOS

IR

Vibrations