Geometry & MOs

Info

ID:	257235
PubChem CID:	103144569
Reduced:	ON2C17H28 (1)
Stoich.:	AB2C17D28 (1)
Weight, g/mol:	266.141913
ΔH_f, kcal/mol:	-78.69
Dipole, Da:	3.67
IP(EA), eV:	-7.88(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-amino-2,5-dimethylphenyl)bicyclo[4.2.0]octa-1,3,5-triene-7-carboxamide

Drug info:

PubChemData

Smile

CCCCCCCCC(=O)NC1=CC(=C(C=C1C)N)C

DOS

IR

Vibrations