Geometry & MOs

Info

ID:	413085
PubChem CID:	135086029
Reduced:	ClFOS2H14C19 (1)
Stoich.:	ABCD2E14F19 (1)
Weight, g/mol:	199.120843
ΔH_f, kcal/mol:	-9.73
Dipole, Da:	4.79
IP(EA), eV:	-8.84(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(E)-2-methoxyethenyl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

C1CSC(=C(C2=CC=C(C=C2)F)C(=O)/C=C/C3=CC=C(C=C3)Cl)S1

DOS

IR

Vibrations