Geometry & MOs

Info

ID:

392923

PubChem CID:

135018491

Reduced:

NO4C29H33 (1)

Stoich.:

AB4C29D33 (1)

Weight, g/mol:

569.25998

ΔHf, kcal/mol:

-97.9

Dipole, Da:

2.08

IP(EA), eV:

 -9.04(0.07)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[(1S,2S,11S,14S)-7,19-dimethoxy-14-methyl-22-hexacyclo[12.11.0.02,11.05,10.015,24.018,23]pentacosa-5(10),6,8,15,18,20,22-heptaenyl]-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

C1[C@H](CN2[C@@H]1[C@@H]([C@H]([C@@H]2COCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)O

DOS

IR

Vibrations