Geometry & MOs

Info

ID:

93534

PubChem CID:

49995147

Reduced:

FO4N5C35H48 (1)

Stoich.:

AB4C5D35E48 (1)

Weight, g/mol:

660.399919

ΔHf, kcal/mol:

-231.01

Dipole, Da:

2.51

IP(EA), eV:

 -8.78(-0.22)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-[4-(diethylcarbamoyl)anilino]-2-oxoethyl]-1-[1-[2-methyl-5-[(2-methylcyclohexyl)carbamoyl]anilino]-1-oxopropan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC(C)C(=O)NC1=CC(=C(C=C1)F)NC(=O)C2CCN(CC2)C(C)C(=O)NC3=C(C=CC(=C3)C(=O)NC4CCCCC4C)C

DOS

IR

Vibrations