Geometry & MOs

Info

ID:

92328

PubChem CID:

49985129

Reduced:

NOC7H10 (6)

Stoich.:

ABC7D10 (6)

Weight, g/mol:

702.334125

ΔHf, kcal/mol:

-287.61

Dipole, Da:

11.89

IP(EA), eV:

 -8.65(-0.4)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[5-(cyclopentylcarbamoyl)-2-methylanilino]-1-oxopropan-2-yl]-N-[3-[4-fluoro-3-[(2-fluorobenzoyl)amino]anilino]-3-oxopropyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1CCCCC1NC(=O)C2=CC(=C(C=C2)OC)NC(=O)C(C(C)C)NC(=O)C3CCN(CC3)C(C)C(=O)NC4=C(C=CC(=C4)C(=O)NC5CCCC5)C

DOS

IR

Vibrations