Geometry & MOs

Info

ID:	198680
PubChem CID:	79135620
Reduced:	ON2C16H18 (1)
Stoich.:	AB2C16D18 (1)
Weight, g/mol:	257.04153
ΔH_f, kcal/mol:	2.12
Dipole, Da:	4.64
IP(EA), eV:	-9.38(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-1-(3-bromophenyl)-2,2-dimethylpropan-1-ol

Drug info:

PubChemData

Smile

C1CC(C2=CC=CC=C21)(CN)C(C3=CC=NC=C3)O

DOS

IR

Vibrations