Geometry & MOs

Info

ID:	155312
PubChem CID:	56352899
Reduced:	SN4O4C23H28 (1)
Stoich.:	AB4C4D23E28 (1)
Weight, g/mol:	418.238706
ΔH_f, kcal/mol:	-86.0
Dipole, Da:	4.53
IP(EA), eV:	-8.95(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(3-chlorophenyl)cyclohexyl]-[4-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)NC(C)C3=NC(=NO3)C

DOS

IR

Vibrations