Geometry & MOs

Info

ID:	425680
PubChem CID:	135127323
Reduced:	O2N3C24H29 (1)
Stoich.:	A2B3C24D29 (1)
Weight, g/mol:	894.800004
ΔH_f, kcal/mol:	-56.34
Dipole, Da:	4.68
IP(EA), eV:	-8.64(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(octadecanoylamino)-3-octadecoxy-3-oxopropyl] 4-amino-2-methyl-4-[2-methyl-4-[(2-methylpropan-2-yl)oxy]butan-2-yl]oxypentanoate

Drug info:

PubChemData

Smile

CC1=NC2=C(N1)C=C(C=C2)C(C)(C)CC3C(=O)NC4=C(O3)C=CC(=C4)C(C)(C)C

DOS

IR

Vibrations