Geometry & MOs

Info

ID:	346556
PubChem CID:	127271060
Reduced:	SN3O4C17H23 (1)
Stoich.:	AB3C4D17E23 (1)
Weight, g/mol:	369.166411
ΔH_f, kcal/mol:	-149.46
Dipole, Da:	4.74
IP(EA), eV:	-9.59(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-N-(1-methyl-5-oxopyrrolidin-3-yl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CN1CC(CC1=O)NC(=O)C2=CC=CC(=C2)CN3CCS(=O)(=O)CC3

DOS

IR

Vibrations