Geometry & MOs

Info

ID:

107101

PubChem CID:

50189952

Reduced:

F2N5O5C34H37 (1)

Stoich.:

A2B5C5D34E37 (1)

Weight, g/mol:

615.285698

ΔHf, kcal/mol:

-246.78

Dipole, Da:

4.22

IP(EA), eV:

 -9.06(-1.09)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-[(2-fluorophenyl)carbamoyl]phenyl]-1-[1-[2-methyl-4-(morpholine-4-carbonyl)anilino]-1-oxopropan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)N2CCOCC2)NC(=O)C(C)N3CCC(CC3)C(=O)NC4=CC=CC=C4C(=O)NC5=CC(=C(C=C5)F)F

DOS

IR

Vibrations