Geometry & MOs

Info

ID:	270533
PubChem CID:	103637034
Reduced:	BrON2C15H23 (1)
Stoich.:	ABC2D15E23 (1)
Weight, g/mol:	348.08373
ΔH_f, kcal/mol:	-42.9
Dipole, Da:	4.43
IP(EA), eV:	-8.8(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-2-[[[2-[(dimethylamino)methyl]phenyl]methylamino]methyl]phenol

Drug info:

PubChemData

Smile

CC(C)N1CCC(CC1)NCC2=C(C=CC(=C2)Br)O

DOS

IR

Vibrations