Geometry & MOs

Info

ID:	342163
PubChem CID:	127264876
Reduced:	N5H15C18 (1)
Stoich.:	A5B15C18 (1)
Weight, g/mol:	294.100442
ΔH_f, kcal/mol:	141.68
Dipole, Da:	4.95
IP(EA), eV:	-9.04(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)ethenyl]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C2=CC=CC=N2)C)C=CC3=C(C=NC=C3)C#N

DOS

IR

Vibrations