Geometry & MOs

Info

ID:	436707
PubChem CID:	135207874
Reduced:	FO2N4H23C25 (1)
Stoich.:	AB2C4D23E25 (1)
Weight, g/mol:	276.01235
ΔH_f, kcal/mol:	-18.83
Dipole, Da:	3.62
IP(EA), eV:	-8.44(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1Z)-2-iodobuta-1,3-dienyl]-N-methylcyclopropanecarboximidamide

Drug info:

PubChemData

Smile

CC1[C@@H]2C[C@@]2(C(C1O)O)N3C=C(C4=C(N=CN=C43)NC5=CC=C(C=C5)F)C6=CC=CC=C6

DOS

IR

Vibrations