Geometry & MOs

Info

ID:	175188
PubChem CID:	75864762
Reduced:	O3N5C24H25 (1)
Stoich.:	A3B5C24D25 (1)
Weight, g/mol:	420.226037
ΔH_f, kcal/mol:	-44.13
Dipole, Da:	5.07
IP(EA), eV:	-8.5(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-O-tert-butyl 3-O-[2-[(4-methoxyphenyl)methyl-methylamino]-2-oxoethyl] piperidine-1,3-dicarboxylate

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CN3C(=O)C(NC3=O)(C)C4=CC=C(C=C4)C#N

DOS

IR

Vibrations