Geometry & MOs

Info

ID:	35571
PubChem CID:	7980049
Reduced:	N2O2F3C20H21 (1)
Stoich.:	A2B2C3D20E21 (1)
Weight, g/mol:	286.168128
ΔH_f, kcal/mol:	-203.49
Dipole, Da:	4.97
IP(EA), eV:	-9.56(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-N'-[(2E,4E)-hexa-2,4-dienoyl]benzohydrazide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)C(=O)NNC(=O)CC2=CC(=CC=C2)C(F)(F)F

DOS

IR

Vibrations