Geometry & MOs

Info

ID:	426917
PubChem CID:	135154545
Reduced:	PF3O5N7C25H35 (1)
Stoich.:	AB3C5D7E25F35 (1)
Weight, g/mol:	255.066221
ΔH_f, kcal/mol:	-363.08
Dipole, Da:	7.28
IP(EA), eV:	-9.18(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 6-chloro-2-(1-ethoxyethenyl)-5-methylpyridine-3-carboxylate

Drug info:

PubChemData

Smile

CCCOC(=O)C(C)(C)NP(=O)(COC(C)CN1C=NC2=C(N=CN=C21)N)N[C@H](C3=CC(=CC=C3)OC)C(F)(F)F

DOS

IR

Vibrations