Geometry & MOs

Info

ID:	376925
PubChem CID:	134222958
Reduced:	FO3N9H24C25 (1)
Stoich.:	AB3C9D24E25 (1)
Weight, g/mol:	219.1987
ΔH_f, kcal/mol:	-17.56
Dipole, Da:	11.75
IP(EA), eV:	-9.1(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1E,4Z,6E)-N,2,7,8,8-pentamethyl-3-methylidenenona-1,4,6-trien-1-amine

Drug info:

PubChemData

Smile

CC1=CNC(=C1C#N)NC(C2CC(CN2C(=O)CN3C4=C(C=C(C=C4)C5=CN=NC=C5)C(=N3)C(=O)N)F)O

DOS

IR

Vibrations