Geometry & MOs

Info

ID:	36060
PubChem CID:	7980710
Reduced:	NO3C21H25 (1)
Stoich.:	AB3C21D25 (1)
Weight, g/mol:	389.129694
ΔH_f, kcal/mol:	-120.03
Dipole, Da:	4.07
IP(EA), eV:	-9.35(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[[(3S)-1,1-dioxothiolan-3-yl]-propylamino]-2-oxoethyl] naphthalene-2-carboxylate

Drug info:

PubChemData

Smile

C[C@H]1CCCC[C@@H]1NC(=O)[C@@H](C)OC(=O)C2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations