Geometry & MOs

Info

ID:	371234
PubChem CID:	127344427
Reduced:	O2N3C16H29 (1)
Stoich.:	A2B3C16D29 (1)
Weight, g/mol:	337.112999
ΔH_f, kcal/mol:	-110.44
Dipole, Da:	2.89
IP(EA), eV:	-8.8(1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-hydroxycyclobutyl)methyl]-3-(2-thiomorpholin-4-ylsulfonylethyl)urea

Drug info:

PubChemData

Smile

C1CCC(C1)N2CCCN(CC2)C(=O)NC3CCCOC3

DOS

IR

Vibrations