Geometry & MOs

Info

ID:	348244
PubChem CID:	127273309
Reduced:	N3O3C21H35 (1)
Stoich.:	A3B3C21D35 (1)
Weight, g/mol:	217.088498
ΔH_f, kcal/mol:	-173.5
Dipole, Da:	3.92
IP(EA), eV:	-9.37(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-1-amino-1-oxopropan-2-yl]thiomorpholine-4-carboxamide

Drug info:

PubChemData

Smile

C1CCC2CC(CCC2C1)NC(=O)N3CCCC(C3)C(=O)N4CCOCC4

DOS

IR

Vibrations