Geometry & MOs

Info

ID:	354013
PubChem CID:	127285670
Reduced:	O2S2N4C17H28 (1)
Stoich.:	A2B2C4D17E28 (1)
Weight, g/mol:	358.203862
ΔH_f, kcal/mol:	-68.54
Dipole, Da:	4.68
IP(EA), eV:	-8.54(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-methylmorpholin-2-yl)methyl]-3-[(3-morpholin-4-ylthiolan-3-yl)methyl]urea

Drug info:

PubChemData

Smile

CCC(C1=NC(=CS1)C)NC(=O)NCC2(CCSC2)N3CCOCC3

DOS

IR

Vibrations