Geometry & MOs

Info

ID:	407540
PubChem CID:	135080287
Reduced:	OC9H12 (1)
Stoich.:	AB9C12 (1)
Weight, g/mol:	196.100048
ΔH_f, kcal/mol:	3.2
Dipole, Da:	1.93
IP(EA), eV:	-8.6(1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1Z,3E)-4-phenylbuta-1,3-dienyl]pyrazole

Drug info:

PubChemData

Smile

CO/C=C\1/CC2CC1C=C2

DOS

IR

Vibrations