Geometry & MOs

Info

ID:

180265

PubChem CID:

76606062

Reduced:

N2O3C16H24 (2)

Stoich.:

A2B3C16D24 (2)

Weight, g/mol:

589.372701

ΔHf, kcal/mol:

-265.27

Dipole, Da:

5.99

IP(EA), eV:

 -8.2(0.19)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl 3-[[cyclopropyl-[3-methoxy-5-(3-methoxypropoxy)benzoyl]amino]methyl]-5-(3-methylbutylcarbamoyl)piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)CNC(=O)C1CN(CC(C1O)C(=O)N(CC2=CN(C3=CC=CC=C32)CCCOC)C4CC4)C(=O)OC(C)(C)C

DOS

IR

Vibrations