Geometry & MOs

Info

ID:	408236
PubChem CID:	135080998
Reduced:	NC7H8 (2)
Stoich.:	AB7C8 (2)
Weight, g/mol:	239.02132
ΔH_f, kcal/mol:	70.01
Dipole, Da:	5.23
IP(EA), eV:	-9.54(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C/C=C(\C)/C(=NCCC1=CC=CC=C1)C#N

DOS

IR

Vibrations