Geometry & MOs

Info

ID:	341318
PubChem CID:	127264011
Reduced:	SN2O4C6H6 (1)
Stoich.:	AB2C4D6E6 (1)
Weight, g/mol:	201.100108
ΔH_f, kcal/mol:	-131.53
Dipole, Da:	2.4
IP(EA), eV:	-9.14(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-ethoxy-4-oxopiperidine-3-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=C(C(=NS1)C(=O)O)N

DOS

IR

Vibrations