Geometry & MOs

Info

ID:	350472
PubChem CID:	127277834
Reduced:	SO2N5C19H29 (1)
Stoich.:	AB2C5D19E29 (1)
Weight, g/mol:	375.198048
ΔH_f, kcal/mol:	-63.98
Dipole, Da:	2.3
IP(EA), eV:	-8.33(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]-3-propanoyl-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)N1CSCC1C(=O)NCC2=CN=C(C=C2)N3CCN(CC3)CC

DOS

IR

Vibrations