Geometry & MOs

Info

ID:	422433
PubChem CID:	135117827
Reduced:	SN2O2C16H20 (1)
Stoich.:	AB2C2D16E20 (1)
Weight, g/mol:	343.189592
ΔH_f, kcal/mol:	-24.89
Dipole, Da:	7.32
IP(EA), eV:	-8.35(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]-5-[(4-methylpiperidin-1-yl)methyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CN(CC1=CC(=CC=C1)SC)CC2=CC(=O)C(=CN2)OC

DOS

IR

Vibrations