Geometry & MOs

Info

ID:	249750
PubChem CID:	103091845
Reduced:	ClNO2C14H20 (1)
Stoich.:	ABC2D14E20 (1)
Weight, g/mol:	189.15175
ΔH_f, kcal/mol:	-71.4
Dipole, Da:	5.36
IP(EA), eV:	-8.76(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(2,3-dimethylphenyl)-3-methylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1Cl)/C=C(/C)\C(C)N)OC

DOS

IR

Vibrations