Geometry & MOs

Info

ID:

185158

PubChem CID:

77263134

Reduced:

FON4C25H27 (1)

Stoich.:

ABC4D25E27 (1)

Weight, g/mol:

514.297762

ΔHf, kcal/mol:

-20.04

Dipole, Da:

4.74

IP(EA), eV:

 -8.28(-0.47)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[4-[[6-(2,2-dimethylpropyl)spiro[3,4-dihydropyrano[2,3-b]pyridine-2,1'-cyclobutane]-4-yl]amino]-3-hydroxy-1-(5-propyl-1,3-thiazol-4-yl)butan-2-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CN=C(C=C1)C2=CC(=CC(=C2)N3CCCCC3)C(=O)NC(C)C4=C(C=CC=N4)F

DOS

IR

Vibrations