Geometry & MOs

Info

ID:

105194

PubChem CID:

50106602

Reduced:

FO4N5C26H32 (1)

Stoich.:

AB4C5D26E32 (1)

Weight, g/mol:

604.337319

ΔHf, kcal/mol:

-201.4

Dipole, Da:

9.03

IP(EA), eV:

 -8.94(-0.41)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[2-(4-carbamoyl-2-methylanilino)-2-oxoethyl]-N-[3-[2-methyl-5-(4-methylpiperidine-1-carbonyl)anilino]-3-oxopropyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)F)NC(=O)CCNC(=O)C2CCN(CC2)CC(=O)NC3=C(C=C(C=C3)C(=O)N)C

DOS

IR

Vibrations