Geometry & MOs

Info

ID:

317977

PubChem CID:

126648131

Reduced:

NO4C33H51 (1)

Stoich.:

AB4C33D51 (1)

Weight, g/mol:

558.382143

ΔHf, kcal/mol:

-197.13

Dipole, Da:

2.14

IP(EA), eV:

 -8.13(0.16)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2E,6E,10E)-13-(6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl)-2,6,10-trimethyl-N-(2-pyridin-2-ylethyl)trideca-2,6,10-trienamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C2=C1OC(CC2)(C)CC/C=C(\C)/CC/C=C(\C)/CCC=C(CO)CO)CN3CCCCC3)O

DOS

IR

Vibrations