Geometry & MOs

Info

ID:

108985

PubChem CID:

50267109

Reduced:

O4N5C34H41 (1)

Stoich.:

A4B5C34D41 (1)

Weight, g/mol:

581.300205

ΔHf, kcal/mol:

-133.59

Dipole, Da:

6.99

IP(EA), eV:

 -8.7(-0.49)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[2-methyl-4-(phenylcarbamoyl)anilino]-1-oxopropan-2-yl]-N-[3-(pyrrolidine-1-carbonyl)phenyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)NC2=CC=CC=C2)NC(=O)C(C)N3CCC(CC3)C(=O)NC4=CC=CC(=C4)C(=O)NCC(C)C

DOS

IR

Vibrations