Geometry & MOs

Info

ID:	159255
PubChem CID:	57269338
Reduced:	C7H11 (2)
Stoich.:	A7B11 (2)
Weight, g/mol:	234.115698
ΔH_f, kcal/mol:	48.82
Dipole, Da:	0.38
IP(EA), eV:	-9.78(1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-2-methyl-3-(2-phenylethenyl)benzonitrile

Drug info:

PubChemData

Smile

CCCCC#CC(CC(C)C)C#CC

DOS

IR

Vibrations