Geometry & MOs

Info

ID:

445519

PubChem CID:

135267607

Reduced:

FO2N3C32H38 (1)

Stoich.:

AB2C3D32E38 (1)

Weight, g/mol:

555.28972

ΔHf, kcal/mol:

-32.95

Dipole, Da:

6.57

IP(EA), eV:

 -8.1(-0.88)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[3-[(1-ethylcyclohexyl)carbamoyl]phenyl]-2-[(3E,5E)-6-fluorohepta-3,5-dien-3-yl]-N-methyl-6H-furo[2,3-e]indole-3-carboxamide

Drug info:

PubChemData

Smile

CC(/C=C\1/C(=C(O/C1=C\2/CNC=C2)C3=CC=C(C=C3)F)C(=O)NC)C4=CC=CCC(=C4)CNCC(C)(C)C

DOS

IR

Vibrations