Geometry & MOs

Info

ID:	365772
PubChem CID:	127318497
Reduced:	SN2O3C17H24 (1)
Stoich.:	AB2C3D17E24 (1)
Weight, g/mol:	399.252192
ΔH_f, kcal/mol:	-116.06
Dipole, Da:	7.84
IP(EA), eV:	-9.42(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(oxolane-2-carbonyl)piperazin-1-yl]-N-(1-phenylcyclopentyl)propanamide

Drug info:

PubChemData

Smile

C1CCC(C1)(C2=CC=CC=C2)NC(=O)CCN3CCCS3(=O)=O

DOS

IR

Vibrations