Geometry & MOs

Info

ID:	70680
PubChem CID:	48413713
Reduced:	SN2O3C23H30 (1)
Stoich.:	AB2C3D23E30 (1)
Weight, g/mol:	412.199822
ΔH_f, kcal/mol:	-87.51
Dipole, Da:	4.73
IP(EA), eV:	-8.82(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CSCC(=O)NC(CN2CCOCC2)C3=CC=C(C=C3)OC

DOS

IR

Vibrations