Geometry & MOs

Info

ID:	346883
PubChem CID:	127271387
Reduced:	SN3O4C19H27 (1)
Stoich.:	AB3C4D19E27 (1)
Weight, g/mol:	343.189592
ΔH_f, kcal/mol:	-168.24
Dipole, Da:	4.67
IP(EA), eV:	-8.88(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,3-benzoxazol-2-yl)-N-[1-(2-methylpiperidin-1-yl)-1-oxopropan-2-yl]propanamide

Drug info:

PubChemData

Smile

CC1CCCCN1C(=O)C(C)NC(=O)C2=CC=C(C=C2)N3CCCS3(=O)=O

DOS

IR

Vibrations