Geometry & MOs

Info

ID:	350101
PubChem CID:	127276974
Reduced:	ON5C20H31 (1)
Stoich.:	AB5C20D31 (1)
Weight, g/mol:	380.140593
ΔH_f, kcal/mol:	7.08
Dipole, Da:	4.42
IP(EA), eV:	-8.72(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC(CC1)N(CC2CC2)CC(=O)N3CCN(CC3)C4=NC=CN=C4

DOS

IR

Vibrations