Geometry & MOs

Info

ID:	296196
PubChem CID:	117560431
Reduced:	NOCl2C11H15 (1)
Stoich.:	ABC2D11E15 (1)
Weight, g/mol:	206.178299
ΔH_f, kcal/mol:	-59.92
Dipole, Da:	4.83
IP(EA), eV:	-8.48(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(2,4-dimethylphenyl)-3-methylbutane-1,2-diamine

Drug info:

PubChemData

Smile

CC(C)C(CO)NC1=C(C=C(C=C1)Cl)Cl

DOS

IR

Vibrations