Geometry & MOs

Info

ID:	326500
PubChem CID:	126687680
Reduced:	ON2C9H20 (1)
Stoich.:	AB2C9D20 (1)
Weight, g/mol:	1445.127074
ΔH_f, kcal/mol:	-55.81
Dipole, Da:	3.28
IP(EA), eV:	-9.09(2.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[[(3R)-3-decoxytetradecanoyl]amino]-3-[(2R,5S)-3-[[(3R)-3-decoxytetradecanoyl]amino]-4-[(3R)-3-decoxytetradecanoyl]oxy-6-(hydroxymethyl)-5-phosphonooxyoxan-2-yl]oxypropanoic acid

Drug info:

PubChemData

Smile

CCC1(CCN(CC1)N)OCC

DOS

IR

Vibrations