Geometry & MOs

Info

ID:	390342
PubChem CID:	134998583
Reduced:	NC7H10 (2)
Stoich.:	AB7C10 (2)
Weight, g/mol:	268.121178
ΔH_f, kcal/mol:	44.46
Dipole, Da:	5.23
IP(EA), eV:	-10.16(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-oxo-4-phenylbutan-2-yl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CCCC/C(=C(\CCCC)/C#N)/C=C\C#N

DOS

IR

Vibrations