Geometry & MOs

Info

ID:	91280
PubChem CID:	49974821
Reduced:	F2N5O5C33H35 (1)
Stoich.:	A2B5C5D33E35 (1)
Weight, g/mol:	507.248169
ΔH_f, kcal/mol:	-239.98
Dipole, Da:	6.72
IP(EA), eV:	-9.06(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-carbamoylphenyl)-1-[2-[2-methyl-5-(morpholine-4-carbonyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)N2CCOCC2)NC(=O)CN3CCC(CC3)C(=O)NC4=CC=CC(=C4)C(=O)NC5=CC(=C(C=C5)F)F

DOS

IR

Vibrations