Geometry & MOs

Info

ID:	453
PubChem CID:	2783
Reduced:	OCl2N2C12H18 (1)
Stoich.:	AB2C2D12E18 (1)
Weight, g/mol:	276.079619
ΔH_f, kcal/mol:	-67.01
Dipole, Da:	2.68
IP(EA), eV:	-8.62(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-amino-3,5-dichlorophenyl)-2-(tert-butylamino)ethanol

Drug info:

PubChemData

Smile

CC(C)(C)NCC(C1=CC(=C(C(=C1)Cl)N)Cl)O

DOS

IR

Vibrations