Geometry & MOs

Info

ID:

435905

PubChem CID:

135192732

Reduced:

O2N3C14H17 (1)

Stoich.:

A2B3C14D17 (1)

Weight, g/mol:

648.216492

ΔHf, kcal/mol:

-27.59

Dipole, Da:

1.75

IP(EA), eV:

 -8.3(-0.8)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

O-[(4S)-2-(4-acetamido-2-oxopyrimidin-1-yl)-4-[[di(propan-2-yl)amino]-(prop-2-enylamino)oxyphosphanyl]oxy-5-methyloxolan-3-yl] 1,1-dioxo-1,4-thiazinane-4-carbothioate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN2C(=CN=C2C(=C1)NC3CC3)C

DOS

IR

Vibrations