Geometry & MOs

Info

ID:

182994

PubChem CID:

76967746

Reduced:

O3C8H16 (4)

Stoich.:

A3B8C16 (4)

Weight, g/mol:

428.18667

ΔHf, kcal/mol:

-679.67

Dipole, Da:

3.03

IP(EA), eV:

-10.32(0.54)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N,N-diethyl-3-hydroxy-4-spiro[chromene-2,4'-piperidine]-4-ylbenzamide;hydrochloride

Drug info:

PubChemData

Smile

CC[C@@H](C)C(=O)OC[C@@H](C)O.CC[C@@H](C)C(=O)OC[C@H](C)O.CC[C@H](C)C(=O)OC[C@@H](C)O.CC[C@H](C)C(=O)OC[C@H](C)O

DOS

IR

Vibrations