Geometry & MOs

Info

ID:	433454
PubChem CID:	135173591
Reduced:	NSO3C11H21 (1)
Stoich.:	ABC3D11E21 (1)
Weight, g/mol:	197.141579
ΔH_f, kcal/mol:	-130.1
Dipole, Da:	5.22
IP(EA), eV:	-9.49(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

azetidin-1-yl-[4-(hydroxymethyl)cyclohexyl]methanone

Drug info:

PubChemData

Smile

CS(=O)(=O)N(C1CCC(CC1)CO)C2CC2

DOS

IR

Vibrations