Geometry & MOs

Info

ID:	349175
PubChem CID:	127274901
Reduced:	SN2O3C19H28 (1)
Stoich.:	AB2C3D19E28 (1)
Weight, g/mol:	399.252192
ΔH_f, kcal/mol:	-120.54
Dipole, Da:	9.36
IP(EA), eV:	-9.04(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[[1-(4-methylbenzoyl)piperidin-4-yl]amino]-3-oxopropyl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CN(CC1CCN(CC1)C(=O)C2CCS(=O)(=O)C2)CC3=CC=CC=C3

DOS

IR

Vibrations