Geometry & MOs

Info

ID:

379586

PubChem CID:

134447783

Reduced:

N2H32C33 (1)

Stoich.:

A2B32C33 (1)

Weight, g/mol:

458.214033

ΔHf, kcal/mol:

148.68

Dipole, Da:

1.83

IP(EA), eV:

 -7.9(-0.01)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(R)-[(5S)-5-[[1-methyl-2-(2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)benzimidazol-5-yl]methyl]pyrrolidin-2-yl]-phenylmethanol

Drug info:

PubChemData

Smile

C1CC(=CC=C(C1)N(C2=CCC=CC=C2)C3=CC=CC=C3)NC4=CC=C(C=C4)C5=CCC=CC=C5

DOS

IR

Vibrations