Geometry & MOs

Info

ID:	346583
PubChem CID:	127271087
Reduced:	N3O3C17H23 (1)
Stoich.:	A3B3C17D23 (1)
Weight, g/mol:	395.151492
ΔH_f, kcal/mol:	-72.34
Dipole, Da:	5.37
IP(EA), eV:	-9.72(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(oxolan-2-yl)propan-2-yl]-4-(3-oxopiperazin-1-yl)sulfonylbenzamide

Drug info:

PubChemData

Smile

CC(C)C1=NOC2=C1C=C(C=N2)C(=O)NC(C)CC3CCCO3

DOS

IR

Vibrations