Geometry & MOs

Info

ID:	155794
PubChem CID:	56367572
Reduced:	SO3N4C23H28 (1)
Stoich.:	AB3C4D23E28 (1)
Weight, g/mol:	371.119129
ΔH_f, kcal/mol:	-93.09
Dipole, Da:	7.37
IP(EA), eV:	-9.06(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-phenylsulfanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-prop-2-enoxypropanamide

Drug info:

PubChemData

Smile

C1CCC(CC1)CNC(=O)CSC2=CC=CC=C2C(=O)NCC(=O)NC3=CN=CC=C3

DOS

IR

Vibrations