Geometry & MOs

Info

ID:

215054

PubChem CID:

85084062

Reduced:

O5N7C37H57 (1)

Stoich.:

A5B7C37D57 (1)

Weight, g/mol:

680.170587

ΔHf, kcal/mol:

-242.07

Dipole, Da:

3.25

IP(EA), eV:

 -9.31(0.24)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1,2,3,3a,4,5,10,11-octahydronaphtho[1,2-g]indolizin-5-ylmethyl [4-[3-(2,4-dinitrophenyl)sulfanylpropanoylamino]phenyl] hydrogen phosphate

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)NC(C(C)C)C(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC(CC(C)C)C(=O)NCCN)N

DOS

IR

Vibrations