Geometry & MOs

Info

ID:	138459
PubChem CID:	52369748
Reduced:	N2O2C11H16 (2)
Stoich.:	A2B2C11D16 (2)
Weight, g/mol:	325.160183
ΔH_f, kcal/mol:	-191.66
Dipole, Da:	5.03
IP(EA), eV:	-8.61(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-[4-(dimethylamino)-3,5-difluorophenyl]-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC2=CC(=CC=C2)NC(=O)N3CCCC3

DOS

IR

Vibrations