Geometry & MOs

Info

ID:	366483
PubChem CID:	127319980
Reduced:	ON5C16H23 (1)
Stoich.:	AB5C16D23 (1)
Weight, g/mol:	381.135842
ΔH_f, kcal/mol:	9.68
Dipole, Da:	4.73
IP(EA), eV:	-8.36(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-hydroxycyclopentyl)methyl]-4-(3-oxopiperazin-1-yl)sulfonylbenzamide

Drug info:

PubChemData

Smile

CC(CNC(=O)C1=CC=CC2=C1NN=C2)N3CCN(CC3)C

DOS

IR

Vibrations