Geometry & MOs

Info

ID:	91270
PubChem CID:	49974728
Reduced:	N5O5C32H43 (1)
Stoich.:	A5B5C32D43 (1)
Weight, g/mol:	521.263819
ΔH_f, kcal/mol:	-206.06
Dipole, Da:	7.38
IP(EA), eV:	-9.06(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(C)NC(=O)C1=C(C(=CC=C1)NC(=O)C2CCN(CC2)CC(=O)NC3=C(C=CC(=C3)C(=O)N4CCOCC4)C)C

DOS

IR

Vibrations