Geometry & MOs

Info

ID:	353521
PubChem CID:	127285098
Reduced:	SN3O4C18H27 (1)
Stoich.:	AB3C4D18E27 (1)
Weight, g/mol:	348.204907
ΔH_f, kcal/mol:	-153.7
Dipole, Da:	5.4
IP(EA), eV:	-8.49(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-morpholin-4-ylbutan-2-yl)propanamide

Drug info:

PubChemData

Smile

CC(C(C)N1CCOCC1)NC(=O)C2=CC=C(C=C2)N3CCCS3(=O)=O

DOS

IR

Vibrations