Geometry & MOs

Info

ID:	328361
PubChem CID:	126700819
Reduced:	SN2O4C26H30 (1)
Stoich.:	AB2C4D26E30 (1)
Weight, g/mol:	206.096775
ΔH_f, kcal/mol:	-92.12
Dipole, Da:	4.52
IP(EA), eV:	-8.17(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethanimidoyl-N'-ethenyl-3-fluoropyridine-2-carboximidamide

Drug info:

PubChemData

Smile

CC1=CC(=CC2=C1N(CCCCO2)C(=C)C3=CC4=C(C=C3)N=C(S4)C)O[C@H](COC)C(=O)C

DOS

IR

Vibrations