Geometry & MOs

Info

ID:

176473

PubChem CID:

76054480

Reduced:

O2N5C13H21 (1)

Stoich.:

A2B5C13D21 (1)

Weight, g/mol:

690.151294

ΔHf, kcal/mol:

-54.77

Dipole, Da:

2.73

IP(EA), eV:

 -9.12(0.04)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[4-acetyl-4-hydroxy-5-(2-hydroxypropanoyl)oxolan-2-yl]-5-[[1-[4-acetyl-4-hydroxy-5-(2-hydroxypropanoyl)oxolan-2-yl]-2,4-dioxo-1,3-diazinan-5-yl]disulfanyl]-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CCNCC2CC(=O)N(C(=O)N2C)C

DOS

IR

Vibrations