Geometry & MOs

Info

ID:

107560

PubChem CID:

50208736

Reduced:

F2O4N5C31H41 (1)

Stoich.:

A2B4C5D31E41 (1)

Weight, g/mol:

672.343547

ΔHf, kcal/mol:

-261.44

Dipole, Da:

6.25

IP(EA), eV:

 -9.0(-0.44)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[4-[(4-fluorophenyl)methylcarbamoyl]-2-methylanilino]-1-oxopropan-2-yl]-N-[2-[2-methyl-5-(propan-2-ylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1=CC(=C(C=C1)NC(=O)CN2CCC(CC2)C(=O)NC(C(C)C)C(=O)NC3=C(C=CC(=C3)F)F)C

DOS

IR

Vibrations