Geometry & MOs

Info

ID:	355000
PubChem CID:	127287861
Reduced:	O3N4C17H24 (1)
Stoich.:	A3B4C17D24 (1)
Weight, g/mol:	347.16452
ΔH_f, kcal/mol:	-116.47
Dipole, Da:	1.95
IP(EA), eV:	-8.68(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[3-(cyclohexanecarbonylamino)-4-fluorophenyl]-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)C2=NC=C(C=C2)CNC(=O)[C@H]3CCC(=O)N3

DOS

IR

Vibrations