Geometry & MOs

Info

ID:	355783
PubChem CID:	127290635
Reduced:	NSO4C20H23 (1)
Stoich.:	ABC4D20E23 (1)
Weight, g/mol:	394.156243
ΔH_f, kcal/mol:	-124.29
Dipole, Da:	8.31
IP(EA), eV:	-9.3(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)sulfonyl]piperidin-2-yl]-morpholin-4-ylmethanone

Drug info:

PubChemData

Smile

CC1CC2=C(O1)C=CC(=C2)S(=O)(=O)NC(C3CCCO3)C4=CC=CC=C4

DOS

IR

Vibrations