Geometry & MOs

Info

ID:

438579

PubChem CID:

135228323

Reduced:

NC23H33 (4)

Stoich.:

AB23C33 (4)

Weight, g/mol:

283.178358

ΔHf, kcal/mol:

8.89

Dipole, Da:

3.75

IP(EA), eV:

 -7.83(-0.68)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl 3-ethyl-4-oxo-2-oxa-8-azaspiro[4.5]decane-8-carboxylate

Drug info:

PubChemData

Smile

CCC1(CCCC(CCC(N(C(=C)C2=CC=CC3=C(C=CC(=C32)C=C)NC(CCC(CCCC(CCCC(CCC(NC4=C5C=CC=C6C5=C(C=C4)C(=C)N(C6=C)C(CCC(CCC1)C)C)C)C)(CC)CCCCCC7=CC=C(C8=C(C=CC=C78)C=C)C=C)C)C)C)C)C)CC

DOS

IR

Vibrations