Geometry & MOs

Info

ID:	355061
PubChem CID:	127287922
Reduced:	BrN2O2C16H19 (1)
Stoich.:	AB2C2D16E19 (1)
Weight, g/mol:	240.147393
ΔH_f, kcal/mol:	-68.18
Dipole, Da:	2.34
IP(EA), eV:	-9.68(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-methyl-N-(oxan-2-ylmethyl)-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(C1)(CNC(=O)[C@H]2CCC(=O)N2)C3=CC(=CC=C3)Br

DOS

IR

Vibrations