Geometry & MOs

Info

ID:	138022
PubChem CID:	52301337
Reduced:	N3O4C21H29 (1)
Stoich.:	A3B4C21D29 (1)
Weight, g/mol:	371.208316
ΔH_f, kcal/mol:	-174.69
Dipole, Da:	5.29
IP(EA), eV:	-9.24(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

N-[5-[[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]carbamoylamino]-2-methylphenyl]acetamide

Drug info:

PubChemData

Smile

C[C@@H]1CN(C[C@@H](O1)C)CC2=CC=CC=C2CNC(=O)CCN3C(=O)CCC3=O

DOS

IR

Vibrations