Geometry & MOs

Info

ID:	444634
PubChem CID:	135263055
Reduced:	NSO5C14H19 (1)
Stoich.:	ABC5D14E19 (1)
Weight, g/mol:	539.314792
ΔH_f, kcal/mol:	-198.74
Dipole, Da:	7.99
IP(EA), eV:	-8.64(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-methylfuran-2-yl)-(4-methyl-2-piperidin-1-ylphenyl)methyl]-2-[1-(oxan-4-ylmethyl)indol-5-yl]acetamide

Drug info:

PubChemData

Smile

CCOC(=O)CC1=CC(=C(C=C1)N2CCS(=O)(=O)CC2)O

DOS

IR

Vibrations