Geometry & MOs

Info

ID:

436260

PubChem CID:

135195928

Reduced:

SN4O11C36H52 (1)

Stoich.:

AB4C11D36E52 (1)

Weight, g/mol:

392.209993

ΔHf, kcal/mol:

-490.61

Dipole, Da:

9.38

IP(EA), eV:

 -9.64(-0.28)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5'-amino-7'-cyclopentyloxy-1'-[(4-methoxyphenyl)methyl]spiro[cyclobutane-1,3'-indole]-2'-one

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C[C@@H](/C=C/S(=O)(=O)C)NC(=O)[C@H]1CCCN1C(=O)[C@H](C2CC2)NC(=O)[C@H](CC(=O)OC(C)(C)C)NC(=O)OCC3=CC=CC=C3

DOS

IR

Vibrations