Geometry & MOs

Info

ID:	33261
PubChem CID:	7885701
Reduced:	NO5C19H25 (1)
Stoich.:	AB5C19D25 (1)
Weight, g/mol:	404.231122
ΔH_f, kcal/mol:	-207.75
Dipole, Da:	7.28
IP(EA), eV:	-9.4(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl] 2-[(4-butoxybenzoyl)amino]acetate

Drug info:

PubChemData

Smile

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)O[C@H]2CCCCC2=O

DOS

IR

Vibrations