Geometry & MOs

Info

ID:	257384
PubChem CID:	103145670
Reduced:	NOC14H17 (1)
Stoich.:	ABC14D17 (1)
Weight, g/mol:	217.092521
ΔH_f, kcal/mol:	-24.67
Dipole, Da:	1.33
IP(EA), eV:	-8.03(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dimethyl-4-(5-methylthiophen-2-yl)aniline

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1N)C)C2=C(OC(=C2)C)C

DOS

IR

Vibrations