Geometry & MOs

Info

ID:	359512
PubChem CID:	127298786
Reduced:	OSN5C18H25 (1)
Stoich.:	ABC5D18E25 (1)
Weight, g/mol:	389.177313
ΔH_f, kcal/mol:	16.7
Dipole, Da:	3.58
IP(EA), eV:	-8.68(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-2-[2-(thiomorpholine-4-carbonyl)pyrrolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=NN(C2=C1C=C(C=N2)CN3CCCC3C(=O)N4CCSCC4)C

DOS

IR

Vibrations