Geometry & MOs

Info

ID:	129839
PubChem CID:	51074019
Reduced:	SN3O4H13C14 (1)
Stoich.:	AB3C4D13E14 (1)
Weight, g/mol:	306.194343
ΔH_f, kcal/mol:	-58.22
Dipole, Da:	4.8
IP(EA), eV:	-9.34(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-(2-ethoxyethyl)piperazine

Drug info:

PubChemData

Smile

CN(CC1=CC=CO1)C(=O)CN2C(=O)OC(=N2)C3=CC=CS3

DOS

IR

Vibrations