Geometry & MOs

Info

ID:	186952
PubChem CID:	77508160
Reduced:	SN4O4C28H40 (1)
Stoich.:	AB4C4D28E40 (1)
Weight, g/mol:	511.304621
ΔH_f, kcal/mol:	-155.75
Dipole, Da:	6.8
IP(EA), eV:	-8.45(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-cyclopropylpiperidin-4-yl)-N-[1-(6-ethoxy-3-oxo-3a,5,6,6a-tetrahydrofuro[3,2-b]pyrrol-4-yl)-4-methyl-1-oxopentan-2-yl]benzamide

Drug info:

PubChemData

Smile

CCCN1CCN(CC1)C2=CC=C(C=C2)C(=O)NC(C3CCCC3)C(=O)N4CC(C5C4C(=O)CO5)SC

DOS

IR

Vibrations