Geometry & MOs

Info

ID:

215528

PubChem CID:

85084868

Reduced:

S3N5O9C52H67 (1)

Stoich.:

A3B5C9D52E67 (1)

Weight, g/mol:

1002.51428

ΔHf, kcal/mol:

-392.13

Dipole, Da:

9.44

IP(EA), eV:

 -8.61(-0.67)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1,3-bis[[6-oxo-3,4,5-tris(phenylmethoxy)-1-propylpiperidin-2-yl]methyl]urea

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CSCC(C(=O)NC(C)C(=O)OCC2=CC=CC=C2)NC(=O)C(CSCC3=CC=C(C=C3)C)NC(=O)C(C(C)O)NC(=O)C(CSCC4=CC=C(C=C4)C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations