Geometry & MOs

Info

ID:	266826
PubChem CID:	103579693
Reduced:	BrON2C15H21 (1)
Stoich.:	ABC2D15E21 (1)
Weight, g/mol:	271.05718
ΔH_f, kcal/mol:	-50.07
Dipole, Da:	5.67
IP(EA), eV:	-8.32(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-bromo-3,5-dimethylanilino)-2-methylpropan-1-ol

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1Br)C)NCC(=O)N2CCCCC2

DOS

IR

Vibrations