Geometry & MOs

Info

ID:

186555

PubChem CID:

77445251

Reduced:

FO3N7C30H40 (1)

Stoich.:

AB3C7D30E40 (1)

Weight, g/mol:

640.353718

ΔHf, kcal/mol:

-115.8

Dipole, Da:

2.29

IP(EA), eV:

 -9.01(-1.1)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[[1-[3,3-dimethyl-2-[2-(methylamino)propanoylamino]butanoyl]pyrrolidin-2-yl]methyl]-N-[2-(4-fluorophenyl)ethyl]-6-phenylimidazo[1,2-a]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NC(C(=O)N1CCCC1CN(CCC2=CC=C(C=C2)F)C(=O)C3=CN4C=CC=NC4=N3)C(C)(C)C)NC

DOS

IR

Vibrations