Geometry & MOs

Info

ID:	35461
PubChem CID:	7979906
Reduced:	SN2O3C21H30 (1)
Stoich.:	AB2C3D21E30 (1)
Weight, g/mol:	341.077848
ΔH_f, kcal/mol:	-125.17
Dipole, Da:	6.18
IP(EA), eV:	-9.08(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chloro-2-nitrophenoxy)-N-(cyclopentylcarbamoyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C[C@@H]3C[C@H]4CC[C@H]3C4

DOS

IR

Vibrations