Geometry & MOs

Info

ID:

188103

PubChem CID:

77668180

Reduced:

SO4N9C25H37 (1)

Stoich.:

AB4C9D25E37 (1)

Weight, g/mol:

559.129232

ΔHf, kcal/mol:

-75.41

Dipole, Da:

8.14

IP(EA), eV:

 -8.57(-1.04)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[3-(6-chloronaphthalen-2-yl)sulfonyl-1-[4-(3-methyl-5-oxo-7H-imidazo[1,5-c]imidazol-6-yl)piperidin-1-yl]-1-oxopropan-2-yl]carbamic acid

Drug info:

PubChemData

Smile

CCN1CCN(CC1)S(=O)(=O)C2=CC(=C(N=C2)OC(C)C)C3NC4C(C(NN4CC)C5=NC=CN=C5)C(=O)N3

DOS

IR

Vibrations