Geometry & MOs

Info

ID:	177077
PubChem CID:	76132544
Reduced:	NO5C16H23 (1)
Stoich.:	AB5C16D23 (1)
Weight, g/mol:	809.624165
ΔH_f, kcal/mol:	-225.62
Dipole, Da:	6.68
IP(EA), eV:	-9.95(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2-aminoacetyl)-[2-[(2-aminoacetyl)amino]acetyl]amino]-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]-N-tetradecyloctadec-9-enamide

Drug info:

PubChemData

Smile

CC(C(C(=O)O)NC(C1=CC=CC=C1)C(=O)OC(C)(C)C)O

DOS

IR

Vibrations