Geometry & MOs

Info

ID:

221550

PubChem CID:

85279576

Reduced:

O14N21C60H115 (1)

Stoich.:

A14B21C60D115 (1)

Weight, g/mol:

1408.914121

ΔHf, kcal/mol:

-764.6

Dipole, Da:

14.52

IP(EA), eV:

 -9.32(0.06)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[2-[3-azido-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4,5,6-tetrahydroxycyclohexyl] [2-(hexacosanoylamino)-3,4-dihydroxynonadecyl] hydrogen phosphate

Drug info:

PubChemData

Smile

CC(C(=O)N)NC(=O)C(C)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(C)NC(=O)C(C)NC(=O)C(CCCCN)NC(=O)C(C)NC(=O)C(C)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(C)NC(=O)C(C)NC(=O)C(CCCCN)N

DOS

IR

Vibrations