Geometry & MOs

Info

ID:	157960
PubChem CID:	56459349
Reduced:	N4O4C21H28 (1)
Stoich.:	A4B4C21D28 (1)
Weight, g/mol:	409.236542
ΔH_f, kcal/mol:	-180.29
Dipole, Da:	4.23
IP(EA), eV:	-8.75(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-methylanilino)-2-oxoethyl]-3-(morpholin-4-ylmethyl)-N-propylbenzamide

Drug info:

PubChemData

Smile

CCCN(CC(=O)NC1=CC=CC=C1C)C(=O)C2CCC3(CC2)C(=O)NC(=O)N3

DOS

IR

Vibrations