Geometry & MOs

Info

ID:

160096

PubChem CID:

57304715

Reduced:

C19H24 (1)

Stoich.:

A19B24 (1)

Weight, g/mol:

804.493625

ΔHf, kcal/mol:

8.96

Dipole, Da:

0.7

IP(EA), eV:

 -8.97(0.46)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

12-[1-(4-amino-3-methoxycyclohexyl)prop-1-en-2-yl]-20-fluoro-1-hydroxy-23,25-dimethoxy-13,19,21,27-tetramethyl-17-prop-2-enyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)CC(C)(C)C2=CC=CC=C2

DOS

IR

Vibrations