Geometry & MOs

Info

ID:	352067
PubChem CID:	127283135
Reduced:	SO2N3C11H21 (1)
Stoich.:	AB2C3D11E21 (1)
Weight, g/mol:	355.229348
ΔH_f, kcal/mol:	-106.33
Dipole, Da:	3.57
IP(EA), eV:	-8.72(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-hydroxycyclohexyl)methyl]-3-[(1-thiomorpholin-4-ylcyclopentyl)methyl]urea

Drug info:

PubChemData

Smile

CC1CN(CCS1)C(=O)NC(C)C(=O)N(C)C

DOS

IR

Vibrations