Geometry & MOs

Info

ID:	368852
PubChem CID:	127330800
Reduced:	SO2N3C18H25 (1)
Stoich.:	AB2C3D18E25 (1)
Weight, g/mol:	375.263425
ΔH_f, kcal/mol:	-89.11
Dipole, Da:	3.44
IP(EA), eV:	-8.5(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-6-methyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1CCCCN1C(=O)C(C)NC(=O)NC2CSC3=CC=CC=C23

DOS

IR

Vibrations