Geometry & MOs

Info

ID:	170737
PubChem CID:	75272308
Reduced:	N3O6C23H25 (1)
Stoich.:	A3B6C23D25 (1)
Weight, g/mol:	485.198442
ΔH_f, kcal/mol:	-173.77
Dipole, Da:	4.47
IP(EA), eV:	-8.62(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-[3-(furan-2-yl)prop-2-enoyl]piperidin-4-yl]methyl]-4-piperidin-1-ylsulfonylbenzamide

Drug info:

PubChemData

Smile

C1CN(CCC1CNC(=O)C(=O)NC2=CC3=C(C=C2)OCCO3)C(=O)C=CC4=CC=CO4

DOS

IR

Vibrations