Geometry & MOs

Info

ID:	364353
PubChem CID:	127315496
Reduced:	O2S2N3C16H21 (1)
Stoich.:	A2B2C3D16E21 (1)
Weight, g/mol:	375.161663
ΔH_f, kcal/mol:	-36.2
Dipole, Da:	4.45
IP(EA), eV:	-8.62(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-oxo-1-[2-(thiomorpholine-4-carbonyl)pyrrolidin-1-yl]propan-2-yl]benzamide

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)C2=CSC(=N2)C3CC3)C(=O)N4CCSCC4

DOS

IR

Vibrations