Geometry & MOs

Info

ID:	217665
PubChem CID:	85088187
Reduced:	N2O2C18H31 (1)
Stoich.:	A2B2C18D31 (1)
Weight, g/mol:	391.174336
ΔH_f, kcal/mol:	-38.47
Dipole, Da:	0.1
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.985503
Charge, e:	0

Chem-info

IUPAC name:

diethyl 2-oxo-6-[2-(2-phenylacetyl)hydrazinyl]piperidine-3,5-dicarboxylate

Drug info:

PubChemData

Smile

CC[N+](CC)(CC)CC(=NOC(C)(C)OC)C1=CC=CC=C1

DOS

IR

Vibrations