Geometry & MOs

Info

ID:	364983
PubChem CID:	127316633
Reduced:	SN2O3C21H26 (1)
Stoich.:	AB2C3D21E26 (1)
Weight, g/mol:	281.173942
ΔH_f, kcal/mol:	-98.21
Dipole, Da:	4.21
IP(EA), eV:	-9.15(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[[1-(dimethylcarbamoyl)cyclopentyl]methyl]-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1CCC2=C(C1)SC=C2C(=O)NCC3=CC(=NC=C3)OC4CCOCC4

DOS

IR

Vibrations