Geometry & MOs

Info

ID:	353943
PubChem CID:	127285583
Reduced:	SO2N4C13H18 (1)
Stoich.:	AB2C4D13E18 (1)
Weight, g/mol:	305.137556
ΔH_f, kcal/mol:	-63.28
Dipole, Da:	0.84
IP(EA), eV:	-8.86(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-methyl-3-oxopiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1C(=O)NCCN1C(=O)NC2=NC3=C(S2)CCCC3

DOS

IR

Vibrations