Geometry & MOs

Info

ID:	212027
PubChem CID:	81059253
Reduced:	ClON2C16H27 (1)
Stoich.:	ABC2D16E27 (1)
Weight, g/mol:	286.06808
ΔH_f, kcal/mol:	-51.8
Dipole, Da:	4.15
IP(EA), eV:	-8.56(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-1-N-methyl-1-N-(2-propan-2-yloxyethyl)benzene-1,4-diamine

Drug info:

PubChemData

Smile

CCC(C(C1=CC=C(C=C1)Cl)N(C)CCOC(C)C)N

DOS

IR

Vibrations