Geometry & MOs

Info

ID:	266831
PubChem CID:	103579707
Reduced:	BrN4C12H15 (1)
Stoich.:	AB4C12D15 (1)
Weight, g/mol:	283.05718
ΔH_f, kcal/mol:	54.66
Dipole, Da:	4.98
IP(EA), eV:	-8.76(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-3,5-dimethyl-N-(oxolan-3-ylmethyl)aniline

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1Br)C)NCC2=NN=CN2C

DOS

IR

Vibrations