Geometry & MOs

Info

ID:	292565
PubChem CID:	116933600
Reduced:	ON2C14H24 (1)
Stoich.:	AB2C14D24 (1)
Weight, g/mol:	248.225249
ΔH_f, kcal/mol:	-54.72
Dipole, Da:	1.78
IP(EA), eV:	-8.65(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-tert-butyl-2-methylphenyl)-3-methylbutane-1,3-diamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)OC)C(CC(C)(C)N)N)C

DOS

IR

Vibrations