Geometry & MOs

Info

ID:	348811
PubChem CID:	127274459
Reduced:	SN4O4C18H20 (1)
Stoich.:	AB4C4D18E20 (1)
Weight, g/mol:	375.161663
ΔH_f, kcal/mol:	-146.93
Dipole, Da:	5.76
IP(EA), eV:	-8.54(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-methyl-5-(thiomorpholine-4-carbonyl)phenyl]-2-(2-oxopiperidin-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)N2CCSCC2)NC(=O)C3=CN(C(=O)NC3=O)C

DOS

IR

Vibrations