Geometry & MOs

Info

ID:	371280
PubChem CID:	127344670
Reduced:	O2N5C17H27 (1)
Stoich.:	A2B5C17D27 (1)
Weight, g/mol:	240.129634
ΔH_f, kcal/mol:	-60.81
Dipole, Da:	3.1
IP(EA), eV:	-8.97(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohex-3-en-1-yl-3-methylthiomorpholine-4-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCC1NC(=O)N2CCN3C=CN=C3C2)CC4CCOC4

DOS

IR

Vibrations