Geometry & MOs

Info

ID:	277284
PubChem CID:	103827632
Reduced:	SO2N3C15H21 (1)
Stoich.:	AB2C3D15E21 (1)
Weight, g/mol:	243.158292
ΔH_f, kcal/mol:	-47.03
Dipole, Da:	5.56
IP(EA), eV:	-8.19(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-4-[3-(methoxymethyl)piperidin-1-yl]-4-oxobutanamide

Drug info:

PubChemData

Smile

CCS(=O)CCNC(=O)[C@H](CC1=CNC2=CC=CC=C21)N

DOS

IR

Vibrations